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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

5-Isopropyl-2-methoxybenzeneboronic acid, 98+%

CAS: 216393-63-4 Molecular Formula: C10H15BO3 Molecular Weight (g/mol): 194.037 MDL Number: MFCD01318154 InChI Key: UTKAEAGLVJFBMK-UHFFFAOYSA-N Synonym: 5-isopropyl-2-methoxyphenylboronic acid,5-isopropyl-2-methoxyphenyl boronic acid,5-isopropyl-2-methoxybenzeneboronic acid,boronic acid, 2-methoxy-5-1-methylethyl phenyl,2-methoxy-5-propan-2-ylphenyl boronic acid,2-methoxy-5-1-methylethyl phenyl boronic acid,2-methoxy-5-propan-2-yl phenyl boronic acid,acmc-1cp8q,2-methoxy-5-propan-2-yl-phenyl boronic acid,5-isopropyl-2-methoxyphenyl boronicacid PubChem CID: 4589190 IUPAC Name: (2-methoxy-5-propan-2-ylphenyl)boronic acid SMILES: B(C1=C(C=CC(=C1)C(C)C)OC)(O)O

PubChem CID 4589190
CAS 216393-63-4
Molecular Weight (g/mol) 194.037
MDL Number MFCD01318154
SMILES B(C1=C(C=CC(=C1)C(C)C)OC)(O)O
Synonym 5-isopropyl-2-methoxyphenylboronic acid,5-isopropyl-2-methoxyphenyl boronic acid,5-isopropyl-2-methoxybenzeneboronic acid,boronic acid, 2-methoxy-5-1-methylethyl phenyl,2-methoxy-5-propan-2-ylphenyl boronic acid,2-methoxy-5-1-methylethyl phenyl boronic acid,2-methoxy-5-propan-2-yl phenyl boronic acid,acmc-1cp8q,2-methoxy-5-propan-2-yl-phenyl boronic acid,5-isopropyl-2-methoxyphenyl boronicacid
IUPAC Name (2-methoxy-5-propan-2-ylphenyl)boronic acid
InChI Key UTKAEAGLVJFBMK-UHFFFAOYSA-N
Molecular Formula C10H15BO3
2

4-Isopropyl-3-methylphenol 99.0+%, TCI America™

CAS: 3228-02-2 Molecular Formula: C10H14O Molecular Weight (g/mol): 150.22 MDL Number: MFCD00010704 InChI Key: IJALWSVNUBBQRA-UHFFFAOYSA-N Synonym: Biosol, 4-Isopropyl-m-cresol PubChem CID: 18597 ChEBI: CHEBI:34429 IUPAC Name: 3-methyl-4-propan-2-ylphenol SMILES: CC1=C(C=CC(=C1)O)C(C)C

PubChem CID 18597
CAS 3228-02-2
Molecular Weight (g/mol) 150.22
ChEBI CHEBI:34429
MDL Number MFCD00010704
SMILES CC1=C(C=CC(=C1)O)C(C)C
Synonym Biosol, 4-Isopropyl-m-cresol
IUPAC Name 3-methyl-4-propan-2-ylphenol
InChI Key IJALWSVNUBBQRA-UHFFFAOYSA-N
Molecular Formula C10H14O
3

5-Isopropyl-m-xylene 85.0+%, TCI America™

CAS: 4706-90-5 Molecular Formula: C11H16 Molecular Weight (g/mol): 148.25 MDL Number: MFCD00026405 InChI Key: RMKJTYPFCFNTGQ-UHFFFAOYSA-N Synonym: 3,5-Dimethylcumene, 3,5-Dimethylisopropylbenzene PubChem CID: 20833 IUPAC Name: 1,3-dimethyl-5-(propan-2-yl)benzene SMILES: CC(C)C1=CC(C)=CC(C)=C1

PubChem CID 20833
CAS 4706-90-5
Molecular Weight (g/mol) 148.25
MDL Number MFCD00026405
SMILES CC(C)C1=CC(C)=CC(C)=C1
Synonym 3,5-Dimethylcumene, 3,5-Dimethylisopropylbenzene
IUPAC Name 1,3-dimethyl-5-(propan-2-yl)benzene
InChI Key RMKJTYPFCFNTGQ-UHFFFAOYSA-N
Molecular Formula C11H16
4

4-Nitrocumene 98.0+%, TCI America™

CAS: 1817-47-6 Molecular Formula: C9H11NO2 Molecular Weight (g/mol): 165.192 MDL Number: MFCD00039746 InChI Key: JXMYUMNAEKRMIP-UHFFFAOYSA-N Synonym: 1-isopropyl-4-nitrobenzene,p-nitrocumene,4-nitrocumene,4-isopropylnitrobenzene,benzene, 1-1-methylethyl-4-nitro,cumene, p-nitro,p-isopropylnitrobenzene,p-nitroisopropylbenzene,4-nitroisopropylbenzene,2-p-nitrophenyl propane PubChem CID: 15749 IUPAC Name: 1-nitro-4-propan-2-ylbenzene SMILES: CC(C)C1=CC=C(C=C1)[N+](=O)[O-]

PubChem CID 15749
CAS 1817-47-6
Molecular Weight (g/mol) 165.192
MDL Number MFCD00039746
SMILES CC(C)C1=CC=C(C=C1)[N+](=O)[O-]
Synonym 1-isopropyl-4-nitrobenzene,p-nitrocumene,4-nitrocumene,4-isopropylnitrobenzene,benzene, 1-1-methylethyl-4-nitro,cumene, p-nitro,p-isopropylnitrobenzene,p-nitroisopropylbenzene,4-nitroisopropylbenzene,2-p-nitrophenyl propane
IUPAC Name 1-nitro-4-propan-2-ylbenzene
InChI Key JXMYUMNAEKRMIP-UHFFFAOYSA-N
Molecular Formula C9H11NO2
5

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
6

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
7

1,3-Bis(2,6-diisopropylphenyl)imidazolinium Chloride 96.0+%, TCI America™

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-bis(propan-2-yl)phenyl]-4,5-dihydro-3H-1λ⁵-imidazol-1-ylium 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-bis(propan-2-yl)phenyl]-4,5-dihydro-3H-1λ⁵-imidazol-1-ylium chloride
InChI Key LWPXTYZKAWSRIP-UHFFFAOYSA-M
Molecular Formula C27H39ClN2
8

2-Methyl-6-isopropylaniline 97%, Thermo Scientific™

CAS: 5266-85-3 Molecular Formula: C10H15N Molecular Weight (g/mol): 149.237 InChI Key: DDTKYVBFPULMGN-UHFFFAOYSA-N Synonym: 2-isopropyl-6-methylaniline,6-isopropyl-o-toluidine,2-methyl-6-isopropylaniline,benzenamine, 2-methyl-6-1-methylethyl,unii-js12fdl562,2-methyl-6-propan-2-yl aniline,6-methyl-2-methylethyl phenylamine,2-amino-m-cymene,pubchem4031,2-amino-3-methylcumene PubChem CID: 78920 IUPAC Name: 2-methyl-6-propan-2-ylaniline SMILES: CC1=C(C(=CC=C1)C(C)C)N

PubChem CID 78920
CAS 5266-85-3
Molecular Weight (g/mol) 149.237
SMILES CC1=C(C(=CC=C1)C(C)C)N
Synonym 2-isopropyl-6-methylaniline,6-isopropyl-o-toluidine,2-methyl-6-isopropylaniline,benzenamine, 2-methyl-6-1-methylethyl,unii-js12fdl562,2-methyl-6-propan-2-yl aniline,6-methyl-2-methylethyl phenylamine,2-amino-m-cymene,pubchem4031,2-amino-3-methylcumene
IUPAC Name 2-methyl-6-propan-2-ylaniline
InChI Key DDTKYVBFPULMGN-UHFFFAOYSA-N
Molecular Formula C10H15N