Cumenes

Organic compounds that consist of a benzene ring with an isopropyl functional group; isopropyl groups consist of an ethyl chain with a methyl group in the first carbon atom. These compounds are also known as isopropylbenzenes.

1 – 15 of 43 results

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Cumene, 99.9%, extra pure

CAS: 98-82-8 Molecular Formula: C₉H₁₂ Molecular Weight (g/mol): 120.19 MDL Number: MFCD00008881 InChI Key: RWGFKTVRMDUZSP-UHFFFAOYSA-N Synonym: isopropylbenzene,2-phenylpropane,cumol,benzene, 1-methylethyl,1-methylethyl benzene,isopropylbenzol,cumeen,isopropilbenzene,isopropylbenzeen,2-fenilpropano PubChem CID: 7406 ChEBI: CHEBI:34656 IUPAC Name: cumene SMILES: CC(C)C1=CC=CC=C1

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Specifications

PubChem CID	7406
CAS	98-82-8
Molecular Weight (g/mol)	120.19
ChEBI	CHEBI:34656
MDL Number	MFCD00008881
SMILES	CC(C)C1=CC=CC=C1
Synonym	isopropylbenzene,2-phenylpropane,cumol,benzene, 1-methylethyl,1-methylethyl benzene,isopropylbenzol,cumeen,isopropilbenzene,isopropylbenzeen,2-fenilpropano
IUPAC Name	cumene
InChI Key	RWGFKTVRMDUZSP-UHFFFAOYSA-N
Molecular Formula	C₉H₁₂

PubChem CID	7406
CAS	98-82-8
Molecular Weight (g/mol)	120.19
ChEBI	CHEBI:34656
MDL Number	MFCD00008881
SMILES	CC(C)C1=CC=CC=C1
Synonym	isopropylbenzene,2-phenylpropane,cumol,benzene, 1-methylethyl,1-methylethyl benzene,isopropylbenzol,cumeen,isopropilbenzene,isopropylbenzeen,2-fenilpropano
IUPAC Name	cumene
InChI Key	RWGFKTVRMDUZSP-UHFFFAOYSA-N
Molecular Formula	C₉H₁₂

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Cumene, 98%, pure

CAS: 98-82-8 MDL Number: MFCD00008881 InChI Key: RWGFKTVRMDUZSP-UHFFFAOYSA-N Synonym: isopropylbenzene,2-phenylpropane,cumol,benzene, 1-methylethyl,1-methylethyl benzene,isopropylbenzol,cumeen,isopropilbenzene,isopropylbenzeen,2-fenilpropano PubChem CID: 7406 ChEBI: CHEBI:34656 IUPAC Name: cumene SMILES: CC(C)C1=CC=CC=C1

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Specifications

PubChem CID	7406
CAS	98-82-8
ChEBI	CHEBI:34656
MDL Number	MFCD00008881
SMILES	CC(C)C1=CC=CC=C1
Synonym	isopropylbenzene,2-phenylpropane,cumol,benzene, 1-methylethyl,1-methylethyl benzene,isopropylbenzol,cumeen,isopropilbenzene,isopropylbenzeen,2-fenilpropano
IUPAC Name	cumene
InChI Key	RWGFKTVRMDUZSP-UHFFFAOYSA-N

1,3,5-Triisopropylbenzene, 95%

CAS: 717-74-8 Molecular Formula: C₁₅H₂₄ Molecular Weight (g/mol): 204.35 MDL Number: MFCD00008890 InChI Key: VUMCUSHVMYIRMB-UHFFFAOYSA-N Synonym: 1,3,5-triisopropylbenzene,2,4,6-triisopropylbenzene,benzene, 1,3,5-tris 1-methylethyl,1,3,5-tris propan-2-yl benzene,unii-fr9y346wpb,benzene, 1,3,5-triisopropyl,fr9y346wpb,benzene, tris 1-methylethyl,pubchem13720,1,5-triisopropylbenzene PubChem CID: 12860 IUPAC Name: 1,3,5-tri(propan-2-yl)benzene SMILES: CC(C)C1=CC(=CC(=C1)C(C)C)C(C)C

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Specifications

PubChem CID	12860
CAS	717-74-8
Molecular Weight (g/mol)	204.35
MDL Number	MFCD00008890
SMILES	CC(C)C1=CC(=CC(=C1)C(C)C)C(C)C
Synonym	1,3,5-triisopropylbenzene,2,4,6-triisopropylbenzene,benzene, 1,3,5-tris 1-methylethyl,1,3,5-tris propan-2-yl benzene,unii-fr9y346wpb,benzene, 1,3,5-triisopropyl,fr9y346wpb,benzene, tris 1-methylethyl,pubchem13720,1,5-triisopropylbenzene
IUPAC Name	1,3,5-tri(propan-2-yl)benzene
InChI Key	VUMCUSHVMYIRMB-UHFFFAOYSA-N
Molecular Formula	C₁₅H₂₄

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2,6-Diisopropylaniline, 90+%

CAS: 24544-04-5 Molecular Formula: C₁₂H₁₉N Molecular Weight (g/mol): 177.29 MDL Number: MFCD00008887 InChI Key: WKBALTUBRZPIPZ-UHFFFAOYSA-N Synonym: 2,6-diisopropylaniline,benzenamine, 2,6-bis 1-methylethyl,2,6-diisopropyl aniline,aniline, 2,6-diisopropyl,diisopropylaniline,2,6-diisopropylphenylamine,2,6-bis propan-2-yl aniline,2,6-dilsopropylaniline,2,6-di propan-2-yl aniline,2,6-bis 1-methylethyl aniline PubChem CID: 32484 IUPAC Name: 2,6-di(propan-2-yl)aniline SMILES: CC(C)C1=C(C(=CC=C1)C(C)C)N

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Specifications

PubChem CID	32484
CAS	24544-04-5
Molecular Weight (g/mol)	177.29
MDL Number	MFCD00008887
SMILES	CC(C)C1=C(C(=CC=C1)C(C)C)N
Synonym	2,6-diisopropylaniline,benzenamine, 2,6-bis 1-methylethyl,2,6-diisopropyl aniline,aniline, 2,6-diisopropyl,diisopropylaniline,2,6-diisopropylphenylamine,2,6-bis propan-2-yl aniline,2,6-dilsopropylaniline,2,6-di propan-2-yl aniline,2,6-bis 1-methylethyl aniline
IUPAC Name	2,6-di(propan-2-yl)aniline
InChI Key	WKBALTUBRZPIPZ-UHFFFAOYSA-N
Molecular Formula	C₁₂H₁₉N

4-Isopropylphenol, 98%

CAS: 99-89-8 Molecular Formula: C₉H₁₂O Molecular Weight (g/mol): 136.19 MDL Number: MFCD00002372 InChI Key: YQUQWHNMBPIWGK-UHFFFAOYSA-N Synonym: 4-isopropylphenol,p-isopropylphenol,p-cumenol,australol,phenol, 4-1-methylethyl,4-1-methylethyl phenol,1-hydroxy-4-isopropylbenzene,4-propan-2-yl phenol,phenol, p-isopropyl,para-isopropylphenol PubChem CID: 7465 IUPAC Name: 4-propan-2-ylphenol SMILES: CC(C)C1=CC=C(C=C1)O

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Specifications

PubChem CID	7465
CAS	99-89-8
Molecular Weight (g/mol)	136.19
MDL Number	MFCD00002372
SMILES	CC(C)C1=CC=C(C=C1)O
Synonym	4-isopropylphenol,p-isopropylphenol,p-cumenol,australol,phenol, 4-1-methylethyl,4-1-methylethyl phenol,1-hydroxy-4-isopropylbenzene,4-propan-2-yl phenol,phenol, p-isopropyl,para-isopropylphenol
IUPAC Name	4-propan-2-ylphenol
InChI Key	YQUQWHNMBPIWGK-UHFFFAOYSA-N
Molecular Formula	C₉H₁₂O

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4-Isopropylaniline, 99%

CAS: 99-88-7 Molecular Formula: C₉H₁₃N Molecular Weight (g/mol): 135.21 MDL Number: MFCD00007900 InChI Key: LRTFPLFDLJYEKT-UHFFFAOYSA-N Synonym: 4-isopropylaniline,cumidine,4-aminocumene,p-isopropylaniline,p-cumidine,4-propan-2-yl aniline,para-isopropylaniline,4-amino-1-isopropylbenzene,cumene, p-amino,aniline, p-isopropyl PubChem CID: 7464 ChEBI: CHEBI:43405 IUPAC Name: 4-propan-2-ylaniline SMILES: CC(C)C1=CC=C(C=C1)N

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Specifications

PubChem CID	7464
CAS	99-88-7
Molecular Weight (g/mol)	135.21
ChEBI	CHEBI:43405
MDL Number	MFCD00007900
SMILES	CC(C)C1=CC=C(C=C1)N
Synonym	4-isopropylaniline,cumidine,4-aminocumene,p-isopropylaniline,p-cumidine,4-propan-2-yl aniline,para-isopropylaniline,4-amino-1-isopropylbenzene,cumene, p-amino,aniline, p-isopropyl
IUPAC Name	4-propan-2-ylaniline
InChI Key	LRTFPLFDLJYEKT-UHFFFAOYSA-N
Molecular Formula	C₉H₁₃N

Sobetirome, MedChemExpress

MedChemExpress Sobetirome (GC-1) is a thyroid hormone receptor β (TRβ)-specific agonist which bind selectively to TRβ-1 with an EC50 of 0.16 μM.

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Specifications

Molecular Weight (g/mol)	328.4
Color	Off-White
Physical Form	Powder
Chemical Name or Material	Sobetirome
Grade	Research
SMILES	O=C(O)COC1=CC(C)=C(CC2=CC=C(O)C(C(C)C)=C2)C(C)=C1
For Use With (Application)	Metabolism-protein/nucleotide metabolism
Percent Purity	95.0%
CAS	211110-63-3
Solubility Information	DMSO : 100 mg/mL (304.51 mM; Need ultrasonic)
Synonym	GC-1 QRX-431
Purity Grade Notes	Research
Recommended Storage	Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Shelf Life	Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Molecular Formula	C₂₀H₂₄O₄
Formula Weight	328.4

Ganetespib, MedChemExpress

MedChemExpress Ganetespib (STA-9090) is a heat shock protein 90 (HSP90) inhibitor which exhibits potent cytotoxicity in a wide variety of hematological and solid tumor cell lines. Ganetespib has antiangiogenic effects in colorectal cancer mediated through inhibition of HIF-1α and STAT3.

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Specifications

Molecular Weight (g/mol)	364.4
Color	White
Physical Form	Solid
Chemical Name or Material	Ganetespib
Grade	Research
SMILES	CN1C2=CC=C(N3C(NN=C3C4=CC(C(C)C)=C(O)C=C4O)=O)C=C2C=C1
For Use With (Application)	Cancer-Kinase/protease
Percent Purity	98.29%
CAS	888216-25-9
Solubility Information	DMSO : ≥ 32 mg/mL (87.82 mM)
Synonym	STA-9090
Purity Grade Notes	Research
Recommended Storage	Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Shelf Life	Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Molecular Formula	C₂₀H₂₀N₄O₃
Formula Weight	364.4

ML-323, MedChemExpress

MedChemExpress ML-323 is a reversible, potent USP1-UAF1 inhibitor with IC50 of 76 nM in a Ub-Rho assay. The measured inhibition constants of ML-323 for the free enzyme (Ki) is 68 nM.

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Specifications

Molecular Weight (g/mol)	384.48
Color	White
Physical Form	Solid
Chemical Name or Material	ML-323
Grade	Research
SMILES	CC1=CN=C(C2=C(C(C)C)C=CC=C2)N=C1NCC3=CC=C(N4N=NC=C4)C=C3
For Use With (Application)	Cancer-programmed cell death
Percent Purity	98.02%
CAS	1572414-83-5
Solubility Information	DMSO : ≥ 49 mg/mL (127.44 mM)
Purity Grade Notes	Research
Recommended Storage	Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Shelf Life	Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Molecular Formula	C₂₃H₂₄N₆
Formula Weight	384.48

E260, MedChemExpress

MedChemExpress E260 is a Fer/FerT kinase inhibitor.

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Specifications

Molecular Weight (g/mol)	438.63
Color	Off-White
Physical Form	Solid
Chemical Name or Material	E260
Grade	Research
SMILES	CC(C)C1=CC=C(C2=CN3C(SC(N4CCC(CN5CCN(C)CC5)CC4)=N3)=N2)C=C1
For Use With (Application)	Cancer-Kinase/protease
Percent Purity	99.91%
CAS	1241537-79-0
Solubility Information	DMSO : 1 mg/mL (2.28 mM; Need ultrasonic)
Purity Grade Notes	Research
Recommended Storage	Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Shelf Life	Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Molecular Formula	C₂₄H₃₄N₆S
Formula Weight	438.63

Upamostat, MedChemExpress

MedChemExpress Upamostat (WX-671) is a serine protease inhibitor. Upamostat is the orally available prodrug of the WX-UK1, which is a urokinase plasminogen activator (uPA) inhibitor.

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Specifications

Molecular Weight (g/mol)	629.81
Color	White
Physical Form	Powder
Chemical Name or Material	Upamostat
Grade	Research
SMILES	O=C(N1CCN(C([C@@H](NS(=O)(C2=C(C(C)C)C=C(C(C)C)C=C2C(C)C)=O)CC3=CC=CC(C(NO)=N)=C3)=O)CC1)OCC
For Use With (Application)	Cancer-Kinase/protease
Percent Purity	98.0%
CAS	590368-25-5
Solubility Information	DMSO : ≥ 250 mg/mL (396.95 mM)
Synonym	WX-671
Purity Grade Notes	Research
Recommended Storage	Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Shelf Life	Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Molecular Formula	C₃₂H₄₇N₅O₆S
Formula Weight	629.81

HC-030031, MedChemExpress

MedChemExpress HC-030031 is a potent and selective TRPA1 inhibitor, which antagonizes AITC- and formalin-evoked calcium influx with IC50s of 6.2±0.2 and 5.3±0.2 μM, respectively.

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Specifications

Molecular Weight (g/mol)	355.39
Color	Off-White
Physical Form	Solid
Chemical Name or Material	HC-030031
Grade	Research
SMILES	O=C1C2=C(N=CN2CC(NC3=CC=C(C(C)C)C=C3)=O)N(C)C(N1C)=O
For Use With (Application)	Neuroscience-Neuromodulation
Percent Purity	95.91%
CAS	349085-38-7
Solubility Information	DMSO : 25 mg/mL (70.35 mM; Need ultrasonic)
Purity Grade Notes	Research
Recommended Storage	Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Shelf Life	Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Molecular Formula	C₁₈H₂₁N₅O₃
Formula Weight	355.39

MN-64, MedChemExpress

MedChemExpress MN-64 is a potent tankyrase 1 inhibitor, with IC50s of 6 nM, 72 nM, 19.1 μM, and 39.4 μM for TNKS1, TNKS2, ARTD1 and ARTD2, respectively.

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Specifications

Molecular Weight (g/mol)	264.32
Color	Yellow
Physical Form	Solid
Chemical Name or Material	MN-64
Grade	Research
SMILES	O=C1C=C(C2=CC=C(C(C)C)C=C2)OC3=CC=CC=C13
For Use With (Application)	Cancer-programmed cell death
Percent Purity	99.73%
CAS	92831-11-3
Solubility Information	DMSO : 100 mg/mL (378.33 mM; Need ultrasonic)
Health Hazard 1	H301
Purity Grade Notes	Research
Recommended Storage	Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Shelf Life	Powder -20°C 3 years, 4°C 2 years∣In solvent -80°C 6 months, -20°C 1 month
Molecular Formula	C₁₈H₁₆O₂
Formula Weight	264.32

Carnosol, MedChemExpress

MedChemExpress Carnosol is a potent Ribosomal S6 Kinase (RSK2) inhibitor that could be useful for treating gastric cancer, with an IC50 of ∼5.5 μM. Carnosol, a Nrf2 activator, increases the nuclear levels of Nrf2 and can promote the expression of heme oxygenase 1 (HMOX1).

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Specifications

Molecular Weight (g/mol)	330.42
Color	White
Physical Form	Solid
Chemical Name or Material	Carnosol
Grade	Research
SMILES	O=C1O[C@]2([H])C3=C(C(O)=C(O)C(C(C)C)=C3)[C@@]41CCCC(C)(C)[C@]4([H])C2
For Use With (Application)	Cancer-Kinase/protease
Percent Purity	97.14%
CAS	5957-80-2
Solubility Information	DMSO : 50 mg/mL (151.32 mM; Need ultrasonic)
Health Hazard 1	H302∣H315∣H319∣H335
Purity Grade Notes	Research
Recommended Storage	-20°C, protect from light∣In solvent : -80°C, 6 months∣-20°C, 1 month (protect from light)
Shelf Life	-20°C, protect from light∣In solvent : -80°C, 6 months∣-20°C, 1 month (protect from light)
Molecular Formula	C₂₀H₂₆O₄
Formula Weight	330.42

Cumenes

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