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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.

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1 – 15 of 27 results
1

2-Isopropylanisole, 98%

CAS: 2944-47-0 Molecular Formula: C10H14O Molecular Weight (g/mol): 150.221 MDL Number: MFCD00798590 InChI Key: NNZRVXTXKISCGS-UHFFFAOYSA-N Synonym: 1-isopropyl-2-methoxybenzene,2-isopropylanisole,o-isopropylanisole,anisole, o-isopropyl,benzene, 1-methoxy-2-1-methylethyl,2-o-methoxyphenyl propane,1-methoxy-2-propan-2-yl benzene,isopropylanisol,isopropyl anisole,acmc-20ansj PubChem CID: 270623 IUPAC Name: 1-methoxy-2-propan-2-ylbenzene SMILES: CC(C)C1=CC=CC=C1OC

PubChem CID 270623
CAS 2944-47-0
Molecular Weight (g/mol) 150.221
MDL Number MFCD00798590
SMILES CC(C)C1=CC=CC=C1OC
Synonym 1-isopropyl-2-methoxybenzene,2-isopropylanisole,o-isopropylanisole,anisole, o-isopropyl,benzene, 1-methoxy-2-1-methylethyl,2-o-methoxyphenyl propane,1-methoxy-2-propan-2-yl benzene,isopropylanisol,isopropyl anisole,acmc-20ansj
IUPAC Name 1-methoxy-2-propan-2-ylbenzene
InChI Key NNZRVXTXKISCGS-UHFFFAOYSA-N
Molecular Formula C10H14O
2

4-Isopropylanisole, 95%

CAS: 4132-48-3 Molecular Formula: C10H14O Molecular Weight (g/mol): 150.22 MDL Number: MFCD00015033 InChI Key: JULZQKLZSNOEEJ-UHFFFAOYSA-N Synonym: 4-isopropylanisole,1-isopropyl-4-methoxybenzene,4-methoxycumene,p-isopropylanisole,anisole, p-isopropyl,2-4-methoxyphenyl propane,benzene, 1-methoxy-4-1-methylethyl,1-methoxy-4-propan-2-yl benzene,p-methoxycumene,p-methoxyisopropylbenzene PubChem CID: 77783 IUPAC Name: 1-methoxy-4-propan-2-ylbenzene SMILES: COC1=CC=C(C=C1)C(C)C

PubChem CID 77783
CAS 4132-48-3
Molecular Weight (g/mol) 150.22
MDL Number MFCD00015033
SMILES COC1=CC=C(C=C1)C(C)C
Synonym 4-isopropylanisole,1-isopropyl-4-methoxybenzene,4-methoxycumene,p-isopropylanisole,anisole, p-isopropyl,2-4-methoxyphenyl propane,benzene, 1-methoxy-4-1-methylethyl,1-methoxy-4-propan-2-yl benzene,p-methoxycumene,p-methoxyisopropylbenzene
IUPAC Name 1-methoxy-4-propan-2-ylbenzene
InChI Key JULZQKLZSNOEEJ-UHFFFAOYSA-N
Molecular Formula C10H14O
3

2-Isopropylbenzeneboronic acid, 97%

CAS: 89787-12-2 Molecular Formula: C9H13BO2 Molecular Weight (g/mol): 164.01 MDL Number: MFCD03411937 InChI Key: KTZUVUWIBZMHMC-UHFFFAOYSA-N Synonym: 2-isopropylphenylboronic acid,2-isopropylphenyl boronic acid,2-isopropylbenzeneboronic acid,2-cumylboronic acid,2-propan-2-ylphenyl boronic acid,o-isopropylphenylboronic acid,2-isopropylphenboronic acid,2-isopropylphenyboronic acid,2-propan-2-yl phenyl boronic acid,boronic acid, 2-1-methylethyl phenyl PubChem CID: 2773477 IUPAC Name: (2-propan-2-ylphenyl)boronic acid SMILES: CC(C)C1=CC=CC=C1B(O)O

PubChem CID 2773477
CAS 89787-12-2
Molecular Weight (g/mol) 164.01
MDL Number MFCD03411937
SMILES CC(C)C1=CC=CC=C1B(O)O
Synonym 2-isopropylphenylboronic acid,2-isopropylphenyl boronic acid,2-isopropylbenzeneboronic acid,2-cumylboronic acid,2-propan-2-ylphenyl boronic acid,o-isopropylphenylboronic acid,2-isopropylphenboronic acid,2-isopropylphenyboronic acid,2-propan-2-yl phenyl boronic acid,boronic acid, 2-1-methylethyl phenyl
IUPAC Name (2-propan-2-ylphenyl)boronic acid
InChI Key KTZUVUWIBZMHMC-UHFFFAOYSA-N
Molecular Formula C9H13BO2
4

2,6-Dibromo-4-isopropylaniline, 98%

CAS: 10546-65-3 Molecular Formula: C9H11Br2N Molecular Weight (g/mol): 293.002 MDL Number: MFCD00015475 InChI Key: CJEBZUFROMNDEK-UHFFFAOYSA-N PubChem CID: 139184 IUPAC Name: 2,6-dibromo-4-propan-2-ylaniline SMILES: CC(C)C1=CC(=C(C(=C1)Br)N)Br

PubChem CID 139184
CAS 10546-65-3
Molecular Weight (g/mol) 293.002
MDL Number MFCD00015475
SMILES CC(C)C1=CC(=C(C(=C1)Br)N)Br
IUPAC Name 2,6-dibromo-4-propan-2-ylaniline
InChI Key CJEBZUFROMNDEK-UHFFFAOYSA-N
Molecular Formula C9H11Br2N
5

4-Isopropylbenzenesulfonyl chloride, 96%

CAS: 54997-90-9 Molecular Formula: C9H11ClO2S Molecular Weight (g/mol): 218.70 MDL Number: MFCD00041510 InChI Key: CETRNHJIXGITKR-UHFFFAOYSA-N Synonym: 4-isopropylbenzenesulfonyl chloride,4-isopropylbenzene-1-sulfonyl chloride,4-isopropylbenzenesulfonylchloride,4-propan-2-yl benzene-1-sulfonyl chloride,4-isopropyl benzenesulfonyl chloride,4-isopropyl-benzenesulfonyl chloride,4-propan-2-yl benzenesulfonyl chloride,4-isopropylbenzensulfonylchloride,4-isopropylphenylsulfonyl chloride,p-isopropylbenzenesulfonyl chloride PubChem CID: 2734882 IUPAC Name: 4-propan-2-ylbenzenesulfonyl chloride SMILES: CC(C)C1=CC=C(C=C1)S(Cl)(=O)=O

PubChem CID 2734882
CAS 54997-90-9
Molecular Weight (g/mol) 218.70
MDL Number MFCD00041510
SMILES CC(C)C1=CC=C(C=C1)S(Cl)(=O)=O
Synonym 4-isopropylbenzenesulfonyl chloride,4-isopropylbenzene-1-sulfonyl chloride,4-isopropylbenzenesulfonylchloride,4-propan-2-yl benzene-1-sulfonyl chloride,4-isopropyl benzenesulfonyl chloride,4-isopropyl-benzenesulfonyl chloride,4-propan-2-yl benzenesulfonyl chloride,4-isopropylbenzensulfonylchloride,4-isopropylphenylsulfonyl chloride,p-isopropylbenzenesulfonyl chloride
IUPAC Name 4-propan-2-ylbenzenesulfonyl chloride
InChI Key CETRNHJIXGITKR-UHFFFAOYSA-N
Molecular Formula C9H11ClO2S
6

2-Isopropylphenyl isothiocyanate, 96%

CAS: 36176-31-5 Molecular Formula: C10H11NS Molecular Weight (g/mol): 177.265 MDL Number: MFCD00022053 InChI Key: QQOOMDSEMQHMIR-UHFFFAOYSA-N Synonym: 2-isopropylphenyl isothiocyanate,1-isopropyl-2-isothiocyanatobenzene,1-isothiocyanato-2-propan-2-yl benzene,benzene, 1-isothiocyanato-2-1-methylethyl,2-methylethyl benzenisothiocyanate,2-isopropylphenylisothiocyanate,acmc-20ansf,2-isopropylphenyl-isothiocyanate,2-iso-propylphenyl isothiocyanate PubChem CID: 142052 IUPAC Name: 1-isothiocyanato-2-propan-2-ylbenzene SMILES: CC(C)C1=CC=CC=C1N=C=S

PubChem CID 142052
CAS 36176-31-5
Molecular Weight (g/mol) 177.265
MDL Number MFCD00022053
SMILES CC(C)C1=CC=CC=C1N=C=S
Synonym 2-isopropylphenyl isothiocyanate,1-isopropyl-2-isothiocyanatobenzene,1-isothiocyanato-2-propan-2-yl benzene,benzene, 1-isothiocyanato-2-1-methylethyl,2-methylethyl benzenisothiocyanate,2-isopropylphenylisothiocyanate,acmc-20ansf,2-isopropylphenyl-isothiocyanate,2-iso-propylphenyl isothiocyanate
IUPAC Name 1-isothiocyanato-2-propan-2-ylbenzene
InChI Key QQOOMDSEMQHMIR-UHFFFAOYSA-N
Molecular Formula C10H11NS
7

1,3-Bis(2,6-diisopropylphenyl)imidazolidinium chloride, 90%

CAS: 258278-25-0 Molecular Formula: C27H39ClN2 Molecular Weight (g/mol): 427.07 MDL Number: MFCD07369796 InChI Key: LWPXTYZKAWSRIP-UHFFFAOYSA-M Synonym: 1,3-bis 2,6-diisopropylphenyl-4,5-dihydro-1h-imidazol-3-ium chloride,sipr.hcl,1,3-bis 2,6-diisopropylphenyl-imidazolidinium-chloride,1,3-bis 2,6-diisopropylphenyl imidazolidinium chloride,n,n'-2,6-diisopropylphenyl dihydroimidazolium chloride,1,3-bis 2,6-diisopropylphenyl-4,5-dihydro-1??-imidazol-1-ylium chloride,1,3-bis 2,6-diisopropylphenyl imidazolinium chloride?,1,3-bis-2,6-diisopropylphenyl imidazolidinium chloride,1,3-bis-2,6-diisopropylphenyl imidazolidiniumchloride,1,3-bis 2,6-bis isopropyl phenyl imidazolin-3-ium chloride PubChem CID: 2734918 IUPAC Name: 1,3-bis[2,6-di(propan-2-yl)phenyl]-4,5-dihydroimidazol-1-ium;chloride SMILES: [Cl-].CC(C)C1=CC=CC(C(C)C)=C1N1CC[N+](=C1)C1=C(C=CC=C1C(C)C)C(C)C

PubChem CID 2734918
CAS 258278-25-0
Molecular Weight (g/mol) 427.07
MDL Number MFCD07369796
SMILES [Cl-].CC(C)C1=CC=CC(C(C)C)=C1N1CC[N+](=C1)C1=C(C=CC=C1C(C)C)C(C)C
Synonym 1,3-bis 2,6-diisopropylphenyl-4,5-dihydro-1h-imidazol-3-ium chloride,sipr.hcl,1,3-bis 2,6-diisopropylphenyl-imidazolidinium-chloride,1,3-bis 2,6-diisopropylphenyl imidazolidinium chloride,n,n'-2,6-diisopropylphenyl dihydroimidazolium chloride,1,3-bis 2,6-diisopropylphenyl-4,5-dihydro-1??-imidazol-1-ylium chloride,1,3-bis 2,6-diisopropylphenyl imidazolinium chloride?,1,3-bis-2,6-diisopropylphenyl imidazolidinium chloride,1,3-bis-2,6-diisopropylphenyl imidazolidiniumchloride,1,3-bis 2,6-bis isopropyl phenyl imidazolin-3-ium chloride
IUPAC Name 1,3-bis[2,6-di(propan-2-yl)phenyl]-4,5-dihydroimidazol-1-ium;chloride
InChI Key LWPXTYZKAWSRIP-UHFFFAOYSA-M
Molecular Formula C27H39ClN2
8

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.

ENCOMPASS_PREFERRED
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
9

Gossypol, MedChemExpress

MedChemExpress Gossypol binds to Bcl-xL protein and Bcl-2 protein with Kis of 0.5-0.6 μM and 0.2-0.3 mM, respectively.

ENCOMPASS_PREFERRED
10

Suvecaltamide, MedChemExpress

MedChemExpress Suvecaltamide (MK-8998; compound 33) is a potent and selective inhibitor of the T-type calcium channel.

ENCOMPASS_PREFERRED
Molecular Weight (g/mol) 380.4
Color White
Physical Form Solid
Chemical Name or Material Suvecaltamide
Grade Research
SMILES O=C(N[C@@H](C1=NC=C(OCC(F)(F)F)C=C1)C)CC2=CC=C(C(C)C)C=C2
For Use With (Application) Neuroscience-Neuromodulation
Percent Purity 98.51%
CAS 953778-58-0
Solubility Information DMSO : 100 mg/mL (262.88 mM; Need ultrasonic)
Synonym MK-8998
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 C20H23F3N2O2
Formula Weight 380.4
11

PZ-2891, MedChemExpress

MedChemExpress PZ-2891 is an orally bioavailable, brain penetrant pantothenate kinase (PANK) modulator. PZ-2891 act as an orthosteric inhibitor at high concentrations and an allosteric activator at lower sub-saturating concentrations. PZ-2891 inhibits human pantothenate kinases PANK1β, PANK2, and PANK3 with IC50s of 40.2 nM, 0.7 nM and 1.3 nM, respectively.

ENCOMPASS_PREFERRED
Molecular Weight (g/mol) 349.43
Color Off-White
Physical Form Solid
Chemical Name or Material PZ-2891
Grade Research
SMILES N#CC1=NN=C(N2CCN(C(CC3=CC=C(C(C)C)C=C3)=O)CC2)C=C1
For Use With (Application) Neuroscience-Neuromodulation
Percent Purity 98.4%
CAS 2170608-82-7
Solubility Information DMSO : 75 mg/mL (214.64 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 C20H23N5O
Formula Weight 349.43
12

Rosmanol, MedChemExpress

MedChemExpress Rosmanol could inhibit the oxidation of low density lipoprotein (LPL) and significantly inhibit lipopolysaccharide induced iNOS and COX-2 expression, with anti-inflammatory effect.

ENCOMPASS_PREFERRED
Molecular Weight (g/mol) 346.42
Color Off-White
Physical Form Solid
Chemical Name or Material Rosmanol
Grade Research
SMILES O=C1O[C@]2([H])[C@@H](O)C3=C(C(O)=C(O)C(C(C)C)=C3)[C@@]41CCCC(C)(C)[C@]24[H]
For Use With (Application) Neuroscience-Neuromodulation
Percent Purity 96.0%
CAS 80225-53-2
Solubility Information DMSO : 100 mg/mL (288.67 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 C20H26O5
Formula Weight 346.42
13

Calcium-Sensing Receptor Antagonists I, MedChemExpress

MedChemExpress Calcium-Sensing Receptor Antagonists I is an antagonist of calcium-sensing parathyroid hormone receptors.

ENCOMPASS_PREFERRED
Molecular Weight (g/mol) 360.45
Color Light Yellow
Physical Form Solid
Chemical Name or Material Calcium-Sensing Receptor Antagonists I
Grade Research
SMILES C#CCOC1=CC2=C(N(C(N=C2C3=CC=C(C(C)C)C=C3)=O)C(C)C)C=C1
Percent Purity 99.91%
CAS 478963-79-0
Solubility Information DMSO : ≥ 100 mg/mL (277.43 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 C23H24N2O2
Formula Weight 360.45
14

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.

ENCOMPASS_PREFERRED
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
15

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).

ENCOMPASS_PREFERRED
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