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Phenylpropanes

Organic compound that contain a propane chain with a phenyl substitution in the following structure: C₆H₅CH₂CH2CH3. These compounds are considered hydrocarbons.

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1

2-Phenyl-2-propanol, 99%

CAS: 617-94-7 Molecular Formula: C9H12O Molecular Weight (g/mol): 136.19 MDL Number: MFCD00004456 InChI Key: BDCFWIDZNLCTMF-UHFFFAOYSA-N Synonym: 2-phenyl-2-propanol,dimethylphenylcarbinol,1-hydroxycumene,dimethylphenylmethanol,alpha-cumyl alcohol,phenyldimethylcarbinol,2-propanol, 2-phenyl,2-phenylisopropanol,alpha,alpha-dimethylbenzyl alcohol,2-phenyl-propan-2-ol PubChem CID: 12053 IUPAC Name: 2-phenylpropan-2-ol SMILES: CC(C)(O)C1=CC=CC=C1

PubChem CID 12053
CAS 617-94-7
Molecular Weight (g/mol) 136.19
MDL Number MFCD00004456
SMILES CC(C)(O)C1=CC=CC=C1
Synonym 2-phenyl-2-propanol,dimethylphenylcarbinol,1-hydroxycumene,dimethylphenylmethanol,alpha-cumyl alcohol,phenyldimethylcarbinol,2-propanol, 2-phenyl,2-phenylisopropanol,alpha,alpha-dimethylbenzyl alcohol,2-phenyl-propan-2-ol
IUPAC Name 2-phenylpropan-2-ol
InChI Key BDCFWIDZNLCTMF-UHFFFAOYSA-N
Molecular Formula C9H12O
2

2-Methyl-1-phenyl-2-propanol, 98+%

CAS: 100-86-7 Molecular Formula: C10H14O Molecular Weight (g/mol): 150.221 MDL Number: MFCD00004465 InChI Key: RIWRBSMFKVOJMN-UHFFFAOYSA-N Synonym: 2-methyl-1-phenyl-2-propanol,benzyldimethylcarbinol,2-benzyl-2-propanol,phenyl-tert-butanol,dimethylbenzylcarbinol,dmbc,1,1-dimethylphenylethanol,1,1-dimethyl-2-phenylethanol,benzylpropyl alcohol,dimethyl benzyl carbinol PubChem CID: 7531 IUPAC Name: 2-methyl-1-phenylpropan-2-ol SMILES: CC(C)(CC1=CC=CC=C1)O

PubChem CID 7531
CAS 100-86-7
Molecular Weight (g/mol) 150.221
MDL Number MFCD00004465
SMILES CC(C)(CC1=CC=CC=C1)O
Synonym 2-methyl-1-phenyl-2-propanol,benzyldimethylcarbinol,2-benzyl-2-propanol,phenyl-tert-butanol,dimethylbenzylcarbinol,dmbc,1,1-dimethylphenylethanol,1,1-dimethyl-2-phenylethanol,benzylpropyl alcohol,dimethyl benzyl carbinol
IUPAC Name 2-methyl-1-phenylpropan-2-ol
InChI Key RIWRBSMFKVOJMN-UHFFFAOYSA-N
Molecular Formula C10H14O
3

2-Phenyl-2-propanol, 98+%

CAS: 617-94-7 Molecular Formula: C9H12O Molecular Weight (g/mol): 136.19 MDL Number: MFCD00004456 InChI Key: BDCFWIDZNLCTMF-UHFFFAOYSA-N Synonym: 2-phenyl-2-propanol,dimethylphenylcarbinol,1-hydroxycumene,dimethylphenylmethanol,alpha-cumyl alcohol,phenyldimethylcarbinol,2-propanol, 2-phenyl,2-phenylisopropanol,alpha,alpha-dimethylbenzyl alcohol,2-phenyl-propan-2-ol PubChem CID: 12053 IUPAC Name: 2-phenylpropan-2-ol SMILES: CC(C)(O)C1=CC=CC=C1

PubChem CID 12053
CAS 617-94-7
Molecular Weight (g/mol) 136.19
MDL Number MFCD00004456
SMILES CC(C)(O)C1=CC=CC=C1
Synonym 2-phenyl-2-propanol,dimethylphenylcarbinol,1-hydroxycumene,dimethylphenylmethanol,alpha-cumyl alcohol,phenyldimethylcarbinol,2-propanol, 2-phenyl,2-phenylisopropanol,alpha,alpha-dimethylbenzyl alcohol,2-phenyl-propan-2-ol
IUPAC Name 2-phenylpropan-2-ol
InChI Key BDCFWIDZNLCTMF-UHFFFAOYSA-N
Molecular Formula C9H12O
4

2-Methyl-2-phenylpropanenitrile, 97%

CAS: 1195-98-8 Molecular Formula: C10H11N Molecular Weight (g/mol): 145.21 InChI Key: PGQTYXFMSZUGOW-UHFFFAOYSA-N Synonym: 2-methyl-2-phenyl-propionitrile,phenylisobutyronitrile,2-phenylisobutyronitrile,2-methyl-2-phenylpropionitrile,2-methyl-2-phenyl-propanenitrile,alpha,alpha-dimethylbenzyl cyanide,benzeneacetonitrile,a,a-dimethyl,alpha,alpha-dimethylphenylacetonitrile,benzeneacetonitrile,,a,,a-dimethyl,benzeneacetonitrile, alpha,alpha-dimethyl PubChem CID: 2797591 IUPAC Name: 2-methyl-2-phenylpropanenitrile SMILES: CC(C)(C#N)C1=CC=CC=C1

PubChem CID 2797591
CAS 1195-98-8
Molecular Weight (g/mol) 145.21
SMILES CC(C)(C#N)C1=CC=CC=C1
Synonym 2-methyl-2-phenyl-propionitrile,phenylisobutyronitrile,2-phenylisobutyronitrile,2-methyl-2-phenylpropionitrile,2-methyl-2-phenyl-propanenitrile,alpha,alpha-dimethylbenzyl cyanide,benzeneacetonitrile,a,a-dimethyl,alpha,alpha-dimethylphenylacetonitrile,benzeneacetonitrile,,a,,a-dimethyl,benzeneacetonitrile, alpha,alpha-dimethyl
IUPAC Name 2-methyl-2-phenylpropanenitrile
InChI Key PGQTYXFMSZUGOW-UHFFFAOYSA-N
Molecular Formula C10H11N
5

2-(4-Bromophenyl)-2-propanol, 97%

CAS: 2077-19-2 Molecular Formula: C9H11BrO Molecular Weight (g/mol): 215.09 MDL Number: MFCD11870096 InChI Key: AOGYBHJTXLXRSM-UHFFFAOYSA-N Synonym: 2-4-bromophenyl propan-2-ol,2-4-bromophenyl-2-propanol,acmc-209fdx,2-4-bromophenyl propan-2-o1,2-4-bromophenyl-propan-2-ol,2-4-bromo-phenyl propan-2-ol,2-4-bromo-phenyl-propan-2-ol,p-bromo-alpha,alpha-dimethylbenzyl alcohol,4-bromo-alpha,alpha-dimethylbenzyl alcohol PubChem CID: 12681920 IUPAC Name: 2-(4-bromophenyl)propan-2-ol SMILES: CC(C)(O)C1=CC=C(Br)C=C1

PubChem CID 12681920
CAS 2077-19-2
Molecular Weight (g/mol) 215.09
MDL Number MFCD11870096
SMILES CC(C)(O)C1=CC=C(Br)C=C1
Synonym 2-4-bromophenyl propan-2-ol,2-4-bromophenyl-2-propanol,acmc-209fdx,2-4-bromophenyl propan-2-o1,2-4-bromophenyl-propan-2-ol,2-4-bromo-phenyl propan-2-ol,2-4-bromo-phenyl-propan-2-ol,p-bromo-alpha,alpha-dimethylbenzyl alcohol,4-bromo-alpha,alpha-dimethylbenzyl alcohol
IUPAC Name 2-(4-bromophenyl)propan-2-ol
InChI Key AOGYBHJTXLXRSM-UHFFFAOYSA-N
Molecular Formula C9H11BrO
6

2-Fluorophenylacetone, 98%

CAS: 2836-82-0 Molecular Formula: C9H9FO Molecular Weight (g/mol): 152.168 MDL Number: MFCD00000325 InChI Key: BANVZEUCJHUPOI-UHFFFAOYSA-N Synonym: 2-fluorophenylacetone,1-2-fluorophenyl propan-2-one,1-2-fluorophenyl acetone,2-fluorophenyl acetone,o-fluorophenylacetone,2-propanone, 1-2-fluorophenyl,acmc-20anub,ksc497e4p,1-2-fluorophenyl acetone # PubChem CID: 76086 IUPAC Name: 1-(2-fluorophenyl)propan-2-one SMILES: CC(=O)CC1=CC=CC=C1F

PubChem CID 76086
CAS 2836-82-0
Molecular Weight (g/mol) 152.168
MDL Number MFCD00000325
SMILES CC(=O)CC1=CC=CC=C1F
Synonym 2-fluorophenylacetone,1-2-fluorophenyl propan-2-one,1-2-fluorophenyl acetone,2-fluorophenyl acetone,o-fluorophenylacetone,2-propanone, 1-2-fluorophenyl,acmc-20anub,ksc497e4p,1-2-fluorophenyl acetone #
IUPAC Name 1-(2-fluorophenyl)propan-2-one
InChI Key BANVZEUCJHUPOI-UHFFFAOYSA-N
Molecular Formula C9H9FO
7

2-Chlorophenylacetone, 96%

CAS: 6305-95-9 Molecular Formula: C9H9ClO Molecular Weight (g/mol): 168.62 MDL Number: MFCD00045175 InChI Key: LWGNDIMNCPMZOF-UHFFFAOYSA-N Synonym: 2-chlorophenylacetone,1-2-chlorophenyl propan-2-one,1-2-chlorophenyl acetone,2-propanone, 1-2-chlorophenyl,acmc-20apcv,2-chlorphenyl acetone,1-2-chlorophenyl acetone #,1-2-chlorophenyl-2-propanone,1-2-chloro-phenyl-propan-2-one PubChem CID: 229355 IUPAC Name: 1-(2-chlorophenyl)propan-2-one SMILES: CC(=O)CC1=CC=CC=C1Cl

PubChem CID 229355
CAS 6305-95-9
Molecular Weight (g/mol) 168.62
MDL Number MFCD00045175
SMILES CC(=O)CC1=CC=CC=C1Cl
Synonym 2-chlorophenylacetone,1-2-chlorophenyl propan-2-one,1-2-chlorophenyl acetone,2-propanone, 1-2-chlorophenyl,acmc-20apcv,2-chlorphenyl acetone,1-2-chlorophenyl acetone #,1-2-chlorophenyl-2-propanone,1-2-chloro-phenyl-propan-2-one
IUPAC Name 1-(2-chlorophenyl)propan-2-one
InChI Key LWGNDIMNCPMZOF-UHFFFAOYSA-N
Molecular Formula C9H9ClO
8

2-Phenylbutyronitrile, 95%

CAS: 769-68-6 Molecular Formula: C10H11N Molecular Weight (g/mol): 145.205 MDL Number: MFCD00001876 InChI Key: IZPUPXNVRNBDSW-UHFFFAOYSA-N Synonym: 2-phenylbutyronitrile,2-phenylbutanentrile,1-cyano-1-phenylpropane,butanenitrile, 2-phenyl,benzeneacetonitrile, .alpha.-ethyl,butyronitrile, 2-phenyl,benzeneacetonitrile, ?-ethyl,.alpha.-phenylbutyronitrile,alpha-phenylbutyronitrile,dl-2-phenylbutyronitrile PubChem CID: 95334 IUPAC Name: 2-phenylbutanenitrile SMILES: CCC(C#N)C1=CC=CC=C1

PubChem CID 95334
CAS 769-68-6
Molecular Weight (g/mol) 145.205
MDL Number MFCD00001876
SMILES CCC(C#N)C1=CC=CC=C1
Synonym 2-phenylbutyronitrile,2-phenylbutanentrile,1-cyano-1-phenylpropane,butanenitrile, 2-phenyl,benzeneacetonitrile, .alpha.-ethyl,butyronitrile, 2-phenyl,benzeneacetonitrile, ?-ethyl,.alpha.-phenylbutyronitrile,alpha-phenylbutyronitrile,dl-2-phenylbutyronitrile
IUPAC Name 2-phenylbutanenitrile
InChI Key IZPUPXNVRNBDSW-UHFFFAOYSA-N
Molecular Formula C10H11N
9

1-(4-Fluorophenyl)-2-methyl-2-propylamine, 96%

CAS: 1200-27-7 Molecular Formula: C10H14FN Molecular Weight (g/mol): 167.227 MDL Number: MFCD00082702 InChI Key: JITFIYFVPMQJOK-UHFFFAOYSA-N Synonym: 1-4-fluorophenyl-2-methylpropan-2-amine,1-4-fluorophenyl-2-methyl-2-propylamine,4-fluorophenyl-2-methyl-2-aminopropane,1-4-fluorophenyl-2-methyl-2-aminopropane,1-4-fluorophenyl-2-methyl-2-propanamine,1-4-fluorophenyl-2-methylprop-2-ylamine,1-4-fluorophenyl-2-methyl-propan-2-amine,1,1-dimethyl-2-4-fluorophenyl ethylamine,2-4-fluoro-phenyl-1,1-dimethyl-ethylamine,acmc-1alz4 PubChem CID: 518471 IUPAC Name: 1-(4-fluorophenyl)-2-methylpropan-2-amine SMILES: CC(C)(CC1=CC=C(C=C1)F)N

PubChem CID 518471
CAS 1200-27-7
Molecular Weight (g/mol) 167.227
MDL Number MFCD00082702
SMILES CC(C)(CC1=CC=C(C=C1)F)N
Synonym 1-4-fluorophenyl-2-methylpropan-2-amine,1-4-fluorophenyl-2-methyl-2-propylamine,4-fluorophenyl-2-methyl-2-aminopropane,1-4-fluorophenyl-2-methyl-2-aminopropane,1-4-fluorophenyl-2-methyl-2-propanamine,1-4-fluorophenyl-2-methylprop-2-ylamine,1-4-fluorophenyl-2-methyl-propan-2-amine,1,1-dimethyl-2-4-fluorophenyl ethylamine,2-4-fluoro-phenyl-1,1-dimethyl-ethylamine,acmc-1alz4
IUPAC Name 1-(4-fluorophenyl)-2-methylpropan-2-amine
InChI Key JITFIYFVPMQJOK-UHFFFAOYSA-N
Molecular Formula C10H14FN
10

2-Bromophenylacetone, 99%

CAS: 21906-31-0 Molecular Formula: C9H9BrO Molecular Weight (g/mol): 213.08 MDL Number: MFCD03410431 InChI Key: TZIAZLUAMDLDJF-UHFFFAOYSA-N Synonym: 2-bromophenylacetone,1-2-bromophenyl propan-2-one,2-bromophenyl acetone,1-2-bromophenyl-2-propanone,1-acetonyl-2-bromobenzene,2-propanone, 1-2-bromophenyl,o-bromo benyl methyl ketone,1-2-bromophenyl acetone,o-bromo benzyl methyl ketone,pubchem23388 PubChem CID: 2734092 IUPAC Name: 1-(2-bromophenyl)propan-2-one SMILES: CC(=O)CC1=CC=CC=C1Br

PubChem CID 2734092
CAS 21906-31-0
Molecular Weight (g/mol) 213.08
MDL Number MFCD03410431
SMILES CC(=O)CC1=CC=CC=C1Br
Synonym 2-bromophenylacetone,1-2-bromophenyl propan-2-one,2-bromophenyl acetone,1-2-bromophenyl-2-propanone,1-acetonyl-2-bromobenzene,2-propanone, 1-2-bromophenyl,o-bromo benyl methyl ketone,1-2-bromophenyl acetone,o-bromo benzyl methyl ketone,pubchem23388
IUPAC Name 1-(2-bromophenyl)propan-2-one
InChI Key TZIAZLUAMDLDJF-UHFFFAOYSA-N
Molecular Formula C9H9BrO
11

2-Methoxyphenylacetone, 97%

CAS: 5211-62-1 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.204 MDL Number: MFCD00008770 InChI Key: GMBFNZCPZFVKAT-UHFFFAOYSA-N Synonym: 2-methoxyphenylacetone,1-2-methoxyphenyl propan-2-one,1-2-methoxyphenyl acetone,o-anisylacetone,o-methoxy phenyl acetone,2-acetonylanisole,o-methoxyphenylaceton,2-propanone, 1-2-methoxyphenyl,2-methoxyphenyl acetone,pubchem23387 PubChem CID: 78887 IUPAC Name: 1-(2-methoxyphenyl)propan-2-one SMILES: CC(=O)CC1=CC=CC=C1OC

PubChem CID 78887
CAS 5211-62-1
Molecular Weight (g/mol) 164.204
MDL Number MFCD00008770
SMILES CC(=O)CC1=CC=CC=C1OC
Synonym 2-methoxyphenylacetone,1-2-methoxyphenyl propan-2-one,1-2-methoxyphenyl acetone,o-anisylacetone,o-methoxy phenyl acetone,2-acetonylanisole,o-methoxyphenylaceton,2-propanone, 1-2-methoxyphenyl,2-methoxyphenyl acetone,pubchem23387
IUPAC Name 1-(2-methoxyphenyl)propan-2-one
InChI Key GMBFNZCPZFVKAT-UHFFFAOYSA-N
Molecular Formula C10H12O2
12

2-(3-Bromophenyl)propan-2-ol, 97%, Thermo Scientific™

CAS: 30951-66-7 Molecular Formula: C9H11BrO Molecular Weight (g/mol): 215.09 InChI Key: ZRFMJMFYMQAUDO-UHFFFAOYSA-N Synonym: 2-3-bromophenyl propan-2-ol,2-3-bromophenyl-2-propanol,acmc-209hjh,2-3-bromophenyl-propan-2-ol,2-3-bromo-phenyl-propan-2-ol,3-alpha-hydroxyisopropyl-1-bromobenzene PubChem CID: 15072383 IUPAC Name: 2-(3-bromophenyl)propan-2-ol SMILES: CC(C)(C1=CC(=CC=C1)Br)O

PubChem CID 15072383
CAS 30951-66-7
Molecular Weight (g/mol) 215.09
SMILES CC(C)(C1=CC(=CC=C1)Br)O
Synonym 2-3-bromophenyl propan-2-ol,2-3-bromophenyl-2-propanol,acmc-209hjh,2-3-bromophenyl-propan-2-ol,2-3-bromo-phenyl-propan-2-ol,3-alpha-hydroxyisopropyl-1-bromobenzene
IUPAC Name 2-(3-bromophenyl)propan-2-ol
InChI Key ZRFMJMFYMQAUDO-UHFFFAOYSA-N
Molecular Formula C9H11BrO
13

2-Methyl-1-phenyl-2-propen-1-ol, tech. 85%

CAS: 4383-08-8 Molecular Formula: C10H12O Molecular Weight (g/mol): 148.21 MDL Number: MFCD00046630 InChI Key: ZGYBYYJGIKPBFD-UHFFFAOYNA-N Synonym: 2-methyl-1-phenyl-2-propen-1-ol,acmc-1bn9z,alpha-isopropenylbenzenemethanol,1-phenyl-2-methyl-2-propen-1-ol,2,6-dichloro-9-methyl-10h-purine PubChem CID: 138211 IUPAC Name: 2-methyl-1-phenylprop-2-en-1-ol SMILES: CC(=C)C(C1=CC=CC=C1)O

PubChem CID 138211
CAS 4383-08-8
Molecular Weight (g/mol) 148.21
MDL Number MFCD00046630
SMILES CC(=C)C(C1=CC=CC=C1)O
Synonym 2-methyl-1-phenyl-2-propen-1-ol,acmc-1bn9z,alpha-isopropenylbenzenemethanol,1-phenyl-2-methyl-2-propen-1-ol,2,6-dichloro-9-methyl-10h-purine
IUPAC Name 2-methyl-1-phenylprop-2-en-1-ol
InChI Key ZGYBYYJGIKPBFD-UHFFFAOYNA-N
Molecular Formula C10H12O
14

2-tert-Butylphenol, 99%

CAS: 88-18-6 Molecular Formula: C10H14O Molecular Weight (g/mol): 150.221 MDL Number: MFCD00002223 InChI Key: WJQOZHYUIDYNHM-UHFFFAOYSA-N Synonym: 2-tert-butyl phenol,2-t-butylphenol,phenol, 2-1,1-dimethylethyl,phenol, o-tert-butyl,o-t-butylphenol,o-tert-butylphenol,tert-butylphenol,2-1,1-dimethylethyl phenol,2-tert-butyl-1-hydroxybenzene,t-butylphenol PubChem CID: 6923 ChEBI: CHEBI:34305 IUPAC Name: 2-tert-butylphenol SMILES: CC(C)(C)C1=CC=CC=C1O

PubChem CID 6923
CAS 88-18-6
Molecular Weight (g/mol) 150.221
ChEBI CHEBI:34305
MDL Number MFCD00002223
SMILES CC(C)(C)C1=CC=CC=C1O
Synonym 2-tert-butyl phenol,2-t-butylphenol,phenol, 2-1,1-dimethylethyl,phenol, o-tert-butyl,o-t-butylphenol,o-tert-butylphenol,tert-butylphenol,2-1,1-dimethylethyl phenol,2-tert-butyl-1-hydroxybenzene,t-butylphenol
IUPAC Name 2-tert-butylphenol
InChI Key WJQOZHYUIDYNHM-UHFFFAOYSA-N
Molecular Formula C10H14O
15

(S)-(+)-2-Phenylbutyric acid, 99%

CAS: 4286-15-1 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.204 MDL Number: MFCD00063164 InChI Key: OFJWFSNDPCAWDK-VIFPVBQESA-N Synonym: s-+-2-phenylbutyric acid,s-2-phenylbutanoic acid,2s-2-phenylbutanoic acid,s-2-phenylbutyric acid,pubchem9874,2-phenylbutyric acid, s,s--2-phenyl-mutyric acid,s-+-2-phenylbutanoic acid,s-+-2-phenyl-mutyric acid PubChem CID: 785329 IUPAC Name: (2S)-2-phenylbutanoic acid SMILES: CCC(C1=CC=CC=C1)C(=O)O

PubChem CID 785329
CAS 4286-15-1
Molecular Weight (g/mol) 164.204
MDL Number MFCD00063164
SMILES CCC(C1=CC=CC=C1)C(=O)O
Synonym s-+-2-phenylbutyric acid,s-2-phenylbutanoic acid,2s-2-phenylbutanoic acid,s-2-phenylbutyric acid,pubchem9874,2-phenylbutyric acid, s,s--2-phenyl-mutyric acid,s-+-2-phenylbutanoic acid,s-+-2-phenyl-mutyric acid
IUPAC Name (2S)-2-phenylbutanoic acid
InChI Key OFJWFSNDPCAWDK-VIFPVBQESA-N
Molecular Formula C10H12O2