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Benzodioxoles

Aromatic organic heterocyclic compounds that consist of a benzene containing the methylenedioxy functional group; methylenedioxy functional groups have two oxygen atoms connected to a methylene bridge.

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1

2-[3,4-(Methylenedioxy)phenyl]ethylamine, 95%

CAS: 1484-85-1 Molecular Formula: C9H11NO2 Molecular Weight (g/mol): 165.192 MDL Number: MFCD00060509 InChI Key: RRIRDPSOCUCGBV-UHFFFAOYSA-N Synonym: homopiperonylamine,3,4-methylenedioxyphenethylamine,methylenedioxyphenethylamine,1,3-benzodioxole-5-ethanamine,2-1,3-benzodioxol-5-yl ethanamine,2-benzo d 1,3 dioxol-5-yl ethanamine,methylenedioxyphenylethylamine,benzo-1,3-dioxole-5-ethylamine,3,4-methylenedioxyphenyl ethylamine,phenethylamine, 3,4-methylenedioxy PubChem CID: 73874 IUPAC Name: 2-(1,3-benzodioxol-5-yl)ethanamine SMILES: C1OC2=C(O1)C=C(C=C2)CCN

PubChem CID 73874
CAS 1484-85-1
Molecular Weight (g/mol) 165.192
MDL Number MFCD00060509
SMILES C1OC2=C(O1)C=C(C=C2)CCN
Synonym homopiperonylamine,3,4-methylenedioxyphenethylamine,methylenedioxyphenethylamine,1,3-benzodioxole-5-ethanamine,2-1,3-benzodioxol-5-yl ethanamine,2-benzo d 1,3 dioxol-5-yl ethanamine,methylenedioxyphenylethylamine,benzo-1,3-dioxole-5-ethylamine,3,4-methylenedioxyphenyl ethylamine,phenethylamine, 3,4-methylenedioxy
IUPAC Name 2-(1,3-benzodioxol-5-yl)ethanamine
InChI Key RRIRDPSOCUCGBV-UHFFFAOYSA-N
Molecular Formula C9H11NO2
2

4-(3,4-Methylenedioxy)phenyl-2-butanone, 98%

CAS: 55418-52-5 Molecular Formula: C11H12O3 Molecular Weight (g/mol): 192.214 MDL Number: MFCD00016910 InChI Key: TZJLGGWGVLADDN-UHFFFAOYSA-N Synonym: piperonyl acetone,piperonylacetone,4-3,4-methylenedioxyphenyl-2-butanone,4-1,3-benzodioxol-5-yl-2-butanone,4-1,3-benzodioxol-5-yl butan-2-one,2-butanone, 4-1,3-benzodioxol-5-yl,unii-081vvc9h34,fema no. 2701,3,4-methylenedioxybenzylacetone,4-benzo d 1,3 dioxol-5-yl butan-2-one PubChem CID: 62098 IUPAC Name: 4-(1,3-benzodioxol-5-yl)butan-2-one SMILES: CC(=O)CCC1=CC2=C(C=C1)OCO2

PubChem CID 62098
CAS 55418-52-5
Molecular Weight (g/mol) 192.214
MDL Number MFCD00016910
SMILES CC(=O)CCC1=CC2=C(C=C1)OCO2
Synonym piperonyl acetone,piperonylacetone,4-3,4-methylenedioxyphenyl-2-butanone,4-1,3-benzodioxol-5-yl-2-butanone,4-1,3-benzodioxol-5-yl butan-2-one,2-butanone, 4-1,3-benzodioxol-5-yl,unii-081vvc9h34,fema no. 2701,3,4-methylenedioxybenzylacetone,4-benzo d 1,3 dioxol-5-yl butan-2-one
IUPAC Name 4-(1,3-benzodioxol-5-yl)butan-2-one
InChI Key TZJLGGWGVLADDN-UHFFFAOYSA-N
Molecular Formula C11H12O3
3

1-(2H-1,3-benzodioxol-5-yl)propan-2-ol, TRC

CAS: 6974-61-4 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.2 Synonym: 1,3-Benzodioxole-5-ethanol, α-methyl-,Phenethyl alcohol, α-methyl-3,4-(methylenedioxy)- (6CI,8CI),α-Methyl-1,3-benzodioxole-5-ethanol,1-(Benzo[1,3]dioxol-5-yl)-2-propanol,1-[3,4-(Methylenedioxy)phenyl]-2-propanol,3-(1,3-Benzodioxol-5-yl)propan-2-ol,NSC 15666,1-(3,4-Methylenedioxyphenyl)propan-2-ol IUPAC Name: 1-(1,3-benzodioxol-5-yl)propan-2-ol SMILES: CC(O)Cc1ccc2OCOc2c1

CAS 6974-61-4
Molecular Weight (g/mol) 180.2
SMILES CC(O)Cc1ccc2OCOc2c1
Synonym 1,3-Benzodioxole-5-ethanol, α-methyl-,Phenethyl alcohol, α-methyl-3,4-(methylenedioxy)- (6CI,8CI),α-Methyl-1,3-benzodioxole-5-ethanol,1-(Benzo[1,3]dioxol-5-yl)-2-propanol,1-[3,4-(Methylenedioxy)phenyl]-2-propanol,3-(1,3-Benzodioxol-5-yl)propan-2-ol,NSC 15666,1-(3,4-Methylenedioxyphenyl)propan-2-ol
IUPAC Name 1-(1,3-benzodioxol-5-yl)propan-2-ol
Molecular Formula C10H12O3
4

FPR A14, TRC

CAS: 329691-12-5 Molecular Formula: C23H20N2O5 Molecular Weight (g/mol): 404.42 Synonym: 1,3-Benzodioxole-5-carboxylic Acid, [[3-methoxy-4-(phenylmethoxy)phenyl]methylene]hydrazide (9CI),FPR A14 SMILES: COc1cc(\C=N/NC(=O)c2ccc3OCOc3c2)ccc1OCc4ccccc4

CAS 329691-12-5
Molecular Weight (g/mol) 404.42
SMILES COc1cc(\C=N/NC(=O)c2ccc3OCOc3c2)ccc1OCc4ccccc4
Synonym 1,3-Benzodioxole-5-carboxylic Acid, [[3-methoxy-4-(phenylmethoxy)phenyl]methylene]hydrazide (9CI),FPR A14
Molecular Formula C23H20N2O5
5

2-[3,4-(Methylenedioxy)phenyl]ethylamine hydrochloride, 95%

CAS: 1653-64-1 Molecular Formula: C9H12ClNO2 Molecular Weight (g/mol): 201.65 MDL Number: MFCD00035193 InChI Key: NDYXFQODWGEGNU-UHFFFAOYSA-N Synonym: 3,4-methylenedioxyphenethylamine hydrochloride,2-3,4-methylenedioxyphenyl ethylamine hydrochloride,phenethylamine, 3,4-methylenedioxy-, hydrochloride,2-benzo d 1,3 dioxol-5-yl ethanamine hydrochloride,homopiperonylamine hydrochloride,1,3-benzodioxole-5-ethanamine, hydrochloride,3,4-methylenedioxy-beta-phenylethylamine hydrochloride,methylenedioxyphenethylamine hydrochloride,3,4-methylenedioxy phenylethylamine hydrochloride,3,4-methylenedioxy-.beta.-phenylethylamine hydrochloride PubChem CID: 74246 IUPAC Name: 2-(1,3-benzodioxol-5-yl)ethanamine;hydrochloride SMILES: C1OC2=C(O1)C=C(C=C2)CCN.Cl

PubChem CID 74246
CAS 1653-64-1
Molecular Weight (g/mol) 201.65
MDL Number MFCD00035193
SMILES C1OC2=C(O1)C=C(C=C2)CCN.Cl
Synonym 3,4-methylenedioxyphenethylamine hydrochloride,2-3,4-methylenedioxyphenyl ethylamine hydrochloride,phenethylamine, 3,4-methylenedioxy-, hydrochloride,2-benzo d 1,3 dioxol-5-yl ethanamine hydrochloride,homopiperonylamine hydrochloride,1,3-benzodioxole-5-ethanamine, hydrochloride,3,4-methylenedioxy-beta-phenylethylamine hydrochloride,methylenedioxyphenethylamine hydrochloride,3,4-methylenedioxy phenylethylamine hydrochloride,3,4-methylenedioxy-.beta.-phenylethylamine hydrochloride
IUPAC Name 2-(1,3-benzodioxol-5-yl)ethanamine;hydrochloride
InChI Key NDYXFQODWGEGNU-UHFFFAOYSA-N
Molecular Formula C9H12ClNO2
6

2-Methyl-3-[(3,4-methylenedioxy)phenyl]propionic acid, Alfa Aesar™

CAS: 77269-66-0 Molecular Formula: C11H12O4 Molecular Weight (g/mol): 208.213 MDL Number: MFCD06203229 InChI Key: DBXAHUCZEXVUKS-UHFFFAOYSA-N Synonym: 2-methyl-3-3,4-methylenedioxy phenyl propionic acid,3-2h-1,3-benzodioxol-5-yl-2-methylpropanoic acid,3-1,3-benzodioxol-5-yl-2-methylpropanoic acid,3-2h-benzo d 1,3-dioxolen-5-yl-2-methylpropanoic acid,acmc-20anr1,1,3-benzodioxole-5-propanoicacid, a-methyl,alpha-methyl-1,3-benzodioxole-5-propionic acid,3-1,3-benzodioxol-5-yl-2-methyl-propanoic acid,1,3-benzodioxole-5-propanoic acid, .alpha.-methyl,alpha-methyl-1,?3-benzodioxole-?5-?propanoic acid PubChem CID: 19614615 IUPAC Name: 3-(1,3-benzodioxol-5-yl)-2-methylpropanoic acid SMILES: CC(CC1=CC2=C(C=C1)OCO2)C(=O)O

PubChem CID 19614615
CAS 77269-66-0
Molecular Weight (g/mol) 208.213
MDL Number MFCD06203229
SMILES CC(CC1=CC2=C(C=C1)OCO2)C(=O)O
Synonym 2-methyl-3-3,4-methylenedioxy phenyl propionic acid,3-2h-1,3-benzodioxol-5-yl-2-methylpropanoic acid,3-1,3-benzodioxol-5-yl-2-methylpropanoic acid,3-2h-benzo d 1,3-dioxolen-5-yl-2-methylpropanoic acid,acmc-20anr1,1,3-benzodioxole-5-propanoicacid, a-methyl,alpha-methyl-1,3-benzodioxole-5-propionic acid,3-1,3-benzodioxol-5-yl-2-methyl-propanoic acid,1,3-benzodioxole-5-propanoic acid, .alpha.-methyl,alpha-methyl-1,?3-benzodioxole-?5-?propanoic acid
IUPAC Name 3-(1,3-benzodioxol-5-yl)-2-methylpropanoic acid
InChI Key DBXAHUCZEXVUKS-UHFFFAOYSA-N
Molecular Formula C11H12O4