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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346 – 360 of 707 results

346

4-Bromophenylacetone 98.0+%, TCI America™

CAS: 6186-22-7 Molecular Formula: C24H24N2O5S Molecular Weight (g/mol): 452.53 MDL Number: MFCD00210401 InChI Key: CDUPPXGKUKTGLU-UHFFFAOYSA-N Synonym: 4-bromophenylacetone,1-4-bromophenyl propan-2-one,1-4-bromophenyl acetone,1-4-bromophenyl-2-propanone,1-4-bromo-phenyl-propan-2-one,p-bromo benzyl methyl ketone,4-bromophenylaceton,4-bromophenylacteone,4-bromophenyl acetone PubChem CID: 736332 IUPAC Name: methyl 2-{2-[N-(3,5-dimethylphenyl)benzenesulfonamido]acetamido}benzoate SMILES: COC(=O)C1=CC=CC=C1NC(=O)CN(C1=CC(C)=CC(C)=C1)S(=O)(=O)C1=CC=CC=C1

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PubChem CID	736332
CAS	6186-22-7
Molecular Weight (g/mol)	452.53
MDL Number	MFCD00210401
SMILES	COC(=O)C1=CC=CC=C1NC(=O)CN(C1=CC(C)=CC(C)=C1)S(=O)(=O)C1=CC=CC=C1
Synonym	4-bromophenylacetone,1-4-bromophenyl propan-2-one,1-4-bromophenyl acetone,1-4-bromophenyl-2-propanone,1-4-bromo-phenyl-propan-2-one,p-bromo benzyl methyl ketone,4-bromophenylaceton,4-bromophenylacteone,4-bromophenyl acetone
IUPAC Name	methyl 2-{2-[N-(3,5-dimethylphenyl)benzenesulfonamido]acetamido}benzoate
InChI Key	CDUPPXGKUKTGLU-UHFFFAOYSA-N
Molecular Formula	C24H24N2O5S

347

Neopentylbenzene 97.0+%, TCI America™

CAS: 1007-26-7 Molecular Formula: C11H16 Molecular Weight (g/mol): 148.249 MDL Number: MFCD00038279 InChI Key: CJGXJKVMUHXVHL-UHFFFAOYSA-N Synonym: neopentylbenzene,benzene, 2,2-dimethylpropyl,neopentyl benzene,benzene, neopentyl,2,2-dimethyl-1-propyl benzene,unii-7mhd03e509,2,2-dimethylpropyl benzene,1-neopentylbenzene,acmc-1bs8x PubChem CID: 13877 IUPAC Name: 2,2-dimethylpropylbenzene SMILES: CC(C)(C)CC1=CC=CC=C1

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PubChem CID	13877
CAS	1007-26-7
Molecular Weight (g/mol)	148.249
MDL Number	MFCD00038279
SMILES	CC(C)(C)CC1=CC=CC=C1
Synonym	neopentylbenzene,benzene, 2,2-dimethylpropyl,neopentyl benzene,benzene, neopentyl,2,2-dimethyl-1-propyl benzene,unii-7mhd03e509,2,2-dimethylpropyl benzene,1-neopentylbenzene,acmc-1bs8x
IUPAC Name	2,2-dimethylpropylbenzene
InChI Key	CJGXJKVMUHXVHL-UHFFFAOYSA-N
Molecular Formula	C11H16

348

Bis(4-tert-butylphenyl)amine 90.0+%, TCI America™

CAS: 4627-22-9 Molecular Formula: C20H27N Molecular Weight (g/mol): 281.443 InChI Key: OPEKHRGERHDLRK-UHFFFAOYSA-N PubChem CID: 458684 IUPAC Name: 4-tert-butyl-N-(4-tert-butylphenyl)aniline SMILES: CC(C)(C)C1=CC=C(C=C1)NC2=CC=C(C=C2)C(C)(C)C

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PubChem CID	458684
CAS	4627-22-9
Molecular Weight (g/mol)	281.443
SMILES	CC(C)(C)C1=CC=C(C=C1)NC2=CC=C(C=C2)C(C)(C)C
IUPAC Name	4-tert-butyl-N-(4-tert-butylphenyl)aniline
InChI Key	OPEKHRGERHDLRK-UHFFFAOYSA-N
Molecular Formula	C20H27N

349

2-(5-tert-Butyl-2-hydroxyphenyl)benzotriazole 98.0+%, TCI America™

CAS: 3147-76-0 Molecular Formula: C16H17N3O Molecular Weight (g/mol): 267.332 MDL Number: MFCD03844795 InChI Key: WXHVQMGINBSVAY-UHFFFAOYSA-N PubChem CID: 76605 IUPAC Name: 2-(benzotriazol-2-yl)-4-tert-butylphenol SMILES: CC(C)(C)C1=CC(=C(C=C1)O)N2N=C3C=CC=CC3=N2

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PubChem CID	76605
CAS	3147-76-0
Molecular Weight (g/mol)	267.332
MDL Number	MFCD03844795
SMILES	CC(C)(C)C1=CC(=C(C=C1)O)N2N=C3C=CC=CC3=N2
IUPAC Name	2-(benzotriazol-2-yl)-4-tert-butylphenol
InChI Key	WXHVQMGINBSVAY-UHFFFAOYSA-N
Molecular Formula	C16H17N3O

350

4-Fluorophenylacetone 98.0+%, TCI America™

CAS: 459-03-0 Molecular Formula: C9H9FO Molecular Weight (g/mol): 152.17 MDL Number: MFCD00000362 InChI Key: ZUEKIIWSVFBTCM-UHFFFAOYSA-N Synonym: 4-fluorophenylacetone,4-fluorophenyl acetone,1-4-fluorophenyl propan-2-one,1-4-fluorophenyl acetone,1-4-fluorophenyl-2-propanone,2-propanone, 1-4-fluorophenyl,p-fluorophenyl acetone,1-acetonyl-4-fluorobenzene,1-4-fluoro-phenyl-propan-2-one PubChem CID: 521187 IUPAC Name: 1-(4-fluorophenyl)propan-2-one SMILES: CC(=O)CC1=CC=C(F)C=C1

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PubChem CID	521187
CAS	459-03-0
Molecular Weight (g/mol)	152.17
MDL Number	MFCD00000362
SMILES	CC(=O)CC1=CC=C(F)C=C1
Synonym	4-fluorophenylacetone,4-fluorophenyl acetone,1-4-fluorophenyl propan-2-one,1-4-fluorophenyl acetone,1-4-fluorophenyl-2-propanone,2-propanone, 1-4-fluorophenyl,p-fluorophenyl acetone,1-acetonyl-4-fluorobenzene,1-4-fluoro-phenyl-propan-2-one
IUPAC Name	1-(4-fluorophenyl)propan-2-one
InChI Key	ZUEKIIWSVFBTCM-UHFFFAOYSA-N
Molecular Formula	C9H9FO

351

2-sec-Butylphenol 97.0+%, TCI America™

CAS: 89-72-5 Molecular Formula: C10H14O Molecular Weight (g/mol): 150.221 MDL Number: MFCD00002225 InChI Key: NGFPWHGISWUQOI-UHFFFAOYSA-N Synonym: 2-sec-butylphenol,o-sec-butylphenol,2-1-methylpropyl phenol,2-2-butyl phenol,phenol, 2-1-methylpropyl,2-butan-2-yl phenol,phenol, o-sec-butyl,2-sec.butylfenol,isopropyl o-cresol,2-sec.butylfenol czech PubChem CID: 6984 ChEBI: CHEBI:34303 IUPAC Name: 2-butan-2-ylphenol SMILES: CCC(C)C1=CC=CC=C1O

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PubChem CID	6984
CAS	89-72-5
Molecular Weight (g/mol)	150.221
ChEBI	CHEBI:34303
MDL Number	MFCD00002225
SMILES	CCC(C)C1=CC=CC=C1O
Synonym	2-sec-butylphenol,o-sec-butylphenol,2-1-methylpropyl phenol,2-2-butyl phenol,phenol, 2-1-methylpropyl,2-butan-2-yl phenol,phenol, o-sec-butyl,2-sec.butylfenol,isopropyl o-cresol,2-sec.butylfenol czech
IUPAC Name	2-butan-2-ylphenol
InChI Key	NGFPWHGISWUQOI-UHFFFAOYSA-N
Molecular Formula	C10H14O

352

1-tert-Butyl-3-ethylbenzene 98.0+%, TCI America™

CAS: 14411-56-4 Molecular Formula: C12H18 Molecular Weight (g/mol): 162.276 MDL Number: MFCD00060845 InChI Key: MUJPTTGNHRHIPH-UHFFFAOYSA-N Synonym: 1-t-butyl-3-ethylbenzene,1-tert-butyl-3-ethylbenzene,benzene, 1-1,1-dimethylethyl-3-ethyl,benzene,1-1,1-dimethylethyl-3-ethyl,butylethylbenzene,m-tert-butyl-ethylbenzene,acmc-1cb13,1-tert-butyl-3-ethyl-benzene,1-1,1-dimethylethyl-3-ethylbenzene,1-tert-butyl-3-ethylbenzene 5g PubChem CID: 139753 IUPAC Name: 1-tert-butyl-3-ethylbenzene SMILES: CCC1=CC(=CC=C1)C(C)(C)C

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PubChem CID	139753
CAS	14411-56-4
Molecular Weight (g/mol)	162.276
MDL Number	MFCD00060845
SMILES	CCC1=CC(=CC=C1)C(C)(C)C
Synonym	1-t-butyl-3-ethylbenzene,1-tert-butyl-3-ethylbenzene,benzene, 1-1,1-dimethylethyl-3-ethyl,benzene,1-1,1-dimethylethyl-3-ethyl,butylethylbenzene,m-tert-butyl-ethylbenzene,acmc-1cb13,1-tert-butyl-3-ethyl-benzene,1-1,1-dimethylethyl-3-ethylbenzene,1-tert-butyl-3-ethylbenzene 5g
IUPAC Name	1-tert-butyl-3-ethylbenzene
InChI Key	MUJPTTGNHRHIPH-UHFFFAOYSA-N
Molecular Formula	C12H18

353

Isobutylbenzene 99.0+%, TCI America™

CAS: 538-93-2 Molecular Formula: C10H14 Molecular Weight (g/mol): 134.22 MDL Number: MFCD00008936 InChI Key: KXUHSQYYJYAXGZ-UHFFFAOYSA-N Synonym: isobutylbenzene,benzene, 2-methylpropyl,2-methylpropyl benzene,benzene, isobutyl,1-phenyl-2-methylpropane,2-methyl-1-phenylpropane,1-phenylisobutane,2-phenyl-2-methylpropane,iso-butylbenzene,1-isobutylbenzene PubChem CID: 10870 ChEBI: CHEBI:43261 IUPAC Name: (2-methylpropyl)benzene SMILES: CC(C)CC1=CC=CC=C1

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PubChem CID	10870
CAS	538-93-2
Molecular Weight (g/mol)	134.22
ChEBI	CHEBI:43261
MDL Number	MFCD00008936
SMILES	CC(C)CC1=CC=CC=C1
Synonym	isobutylbenzene,benzene, 2-methylpropyl,2-methylpropyl benzene,benzene, isobutyl,1-phenyl-2-methylpropane,2-methyl-1-phenylpropane,1-phenylisobutane,2-phenyl-2-methylpropane,iso-butylbenzene,1-isobutylbenzene
IUPAC Name	(2-methylpropyl)benzene
InChI Key	KXUHSQYYJYAXGZ-UHFFFAOYSA-N
Molecular Formula	C10H14

354

4-tert-Butylbenzyl Chloride 89.0+%, TCI America™

CAS: 19692-45-6 Molecular Formula: C11H15Cl Molecular Weight (g/mol): 182.69 MDL Number: MFCD00000918 InChI Key: WAXIFMGAKWIFDQ-UHFFFAOYSA-N Synonym: 4-tert-butylbenzyl chloride,1-tert-butyl-4-chloromethyl benzene,p-tert-butylbenzyl chloride,4-tert-butyl benzyl chloride,benzene, 1-chloromethyl-4-1,1-dimethylethyl,4-tert-butyl benzylchloride,p-t-butylbenzyl chloride,1-chloromethyl-4-tert-butylbenzene,p-tert-butyl-.alpha.-chlorotoluene PubChem CID: 88198 IUPAC Name: 1-tert-butyl-4-(chloromethyl)benzene SMILES: CC(C)(C)C1=CC=C(CCl)C=C1

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PubChem CID	88198
CAS	19692-45-6
Molecular Weight (g/mol)	182.69
MDL Number	MFCD00000918
SMILES	CC(C)(C)C1=CC=C(CCl)C=C1
Synonym	4-tert-butylbenzyl chloride,1-tert-butyl-4-chloromethyl benzene,p-tert-butylbenzyl chloride,4-tert-butyl benzyl chloride,benzene, 1-chloromethyl-4-1,1-dimethylethyl,4-tert-butyl benzylchloride,p-t-butylbenzyl chloride,1-chloromethyl-4-tert-butylbenzene,p-tert-butyl-.alpha.-chlorotoluene
IUPAC Name	1-tert-butyl-4-(chloromethyl)benzene
InChI Key	WAXIFMGAKWIFDQ-UHFFFAOYSA-N
Molecular Formula	C11H15Cl

355

4-tert-Butylbenzoic Acid 99.0+%, TCI America™

CAS: 98-73-7 Molecular Formula: C11H14O2 Molecular Weight (g/mol): 178.23 MDL Number: MFCD00002563 InChI Key: KDVYCTOWXSLNNI-UHFFFAOYSA-N Synonym: 4-tert-butyl benzoic acid,tbba,p-tert-butylbenzoic acid,benzoic acid, 4-1,1-dimethylethyl,4-t-butylbenzoic acid,benzoic acid, p-tert-butyl,4-tert-butyl-benzoic acid,p-t-butylbenzoic acid,4-tert-butylbenzoicacid,unii-43z7t3vn0r PubChem CID: 7403 ChEBI: CHEBI:34443 IUPAC Name: 4-tert-butylbenzoic acid SMILES: CC(C)(C)C1=CC=C(C=C1)C(O)=O

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PubChem CID	7403
CAS	98-73-7
Molecular Weight (g/mol)	178.23
ChEBI	CHEBI:34443
MDL Number	MFCD00002563
SMILES	CC(C)(C)C1=CC=C(C=C1)C(O)=O
Synonym	4-tert-butyl benzoic acid,tbba,p-tert-butylbenzoic acid,benzoic acid, 4-1,1-dimethylethyl,4-t-butylbenzoic acid,benzoic acid, p-tert-butyl,4-tert-butyl-benzoic acid,p-t-butylbenzoic acid,4-tert-butylbenzoicacid,unii-43z7t3vn0r
IUPAC Name	4-tert-butylbenzoic acid
InChI Key	KDVYCTOWXSLNNI-UHFFFAOYSA-N
Molecular Formula	C11H14O2

356

2,4,6-Tri-tert-butylnitrosobenzene 98.0+%, TCI America™

CAS: 24973-59-9 Molecular Formula: C18H29NO Molecular Weight (g/mol): 275.44 MDL Number: MFCD00008817 InChI Key: OSICDPWAPKXXHT-UHFFFAOYSA-N PubChem CID: 90676 IUPAC Name: 1,3,5-tri-tert-butyl-2-nitrosobenzene SMILES: CC(C)(C)C1=CC(=C(N=O)C(=C1)C(C)(C)C)C(C)(C)C

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PubChem CID	90676
CAS	24973-59-9
Molecular Weight (g/mol)	275.44
MDL Number	MFCD00008817
SMILES	CC(C)(C)C1=CC(=C(N=O)C(=C1)C(C)(C)C)C(C)(C)C
IUPAC Name	1,3,5-tri-tert-butyl-2-nitrosobenzene
InChI Key	OSICDPWAPKXXHT-UHFFFAOYSA-N
Molecular Formula	C18H29NO

357

Methyl 3,5-Di-tert-butylbenzoate 98.0+%, TCI America™

CAS: 64277-87-8 Molecular Formula: C16H24O2 Molecular Weight (g/mol): 248.37 MDL Number: MFCD03844786 InChI Key: ZEIOQJMJXFVPOG-UHFFFAOYSA-N Synonym: 3,5-Di-tert-butylbenzoic Acid Methyl Ester PubChem CID: 13267559 IUPAC Name: methyl 3,5-di-tert-butylbenzoate SMILES: COC(=O)C1=CC(=CC(=C1)C(C)(C)C)C(C)(C)C

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PubChem CID	13267559
CAS	64277-87-8
Molecular Weight (g/mol)	248.37
MDL Number	MFCD03844786
SMILES	COC(=O)C1=CC(=CC(=C1)C(C)(C)C)C(C)(C)C
Synonym	3,5-Di-tert-butylbenzoic Acid Methyl Ester
IUPAC Name	methyl 3,5-di-tert-butylbenzoate
InChI Key	ZEIOQJMJXFVPOG-UHFFFAOYSA-N
Molecular Formula	C16H24O2

358

3,4-Dimethoxyphenylacetone 97.0+%, TCI America™

CAS: 776-99-8 Molecular Formula: C11H14O3 Molecular Weight (g/mol): 194.23 MDL Number: MFCD00008772 InChI Key: UMYZWICEDUEWIM-UHFFFAOYSA-N Synonym: 3,4-dimethoxyphenylacetone,1-3,4-dimethoxyphenyl propan-2-one,3,4-dimethoxyphenyl acetone,veratryl-2-propanone,1-3,4-dimethoxyphenyl-2-propanone,veratryl acetone,3,4-dimethoxybenzyl methyl ketone,1-3,4-dimethoxyphenyl acetone,2-propanone, 1-3,4-dimethoxyphenyl,veratryl methyl ketone PubChem CID: 69896 IUPAC Name: 1-(3,4-dimethoxyphenyl)propan-2-one SMILES: COC1=CC=C(CC(C)=O)C=C1OC

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PubChem CID	69896
CAS	776-99-8
Molecular Weight (g/mol)	194.23
MDL Number	MFCD00008772
SMILES	COC1=CC=C(CC(C)=O)C=C1OC
Synonym	3,4-dimethoxyphenylacetone,1-3,4-dimethoxyphenyl propan-2-one,3,4-dimethoxyphenyl acetone,veratryl-2-propanone,1-3,4-dimethoxyphenyl-2-propanone,veratryl acetone,3,4-dimethoxybenzyl methyl ketone,1-3,4-dimethoxyphenyl acetone,2-propanone, 1-3,4-dimethoxyphenyl,veratryl methyl ketone
IUPAC Name	1-(3,4-dimethoxyphenyl)propan-2-one
InChI Key	UMYZWICEDUEWIM-UHFFFAOYSA-N
Molecular Formula	C11H14O3

359

tert-Amylbenzene 97.0+%, TCI America™

CAS: 2049-95-8 Molecular Formula: C11H16 Molecular Weight (g/mol): 148.249 MDL Number: MFCD00015187 InChI Key: QHTJSSMHBLGUHV-UHFFFAOYSA-N Synonym: tert-amylbenzene,tert-pentylbenzene,2-methyl-2-phenylbutane,1,1-dimethylpropyl benzene,benzene, 1,1-dimethylpropyl,benzene, tert-pentyl,2-phenyl-2-methylbutane,t-amylbenzene,2-methylbutan-2-yl benzene,tert-amyl benzene PubChem CID: 16295 IUPAC Name: 2-methylbutan-2-ylbenzene SMILES: CCC(C)(C)C1=CC=CC=C1

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PubChem CID	16295
CAS	2049-95-8
Molecular Weight (g/mol)	148.249
MDL Number	MFCD00015187
SMILES	CCC(C)(C)C1=CC=CC=C1
Synonym	tert-amylbenzene,tert-pentylbenzene,2-methyl-2-phenylbutane,1,1-dimethylpropyl benzene,benzene, 1,1-dimethylpropyl,benzene, tert-pentyl,2-phenyl-2-methylbutane,t-amylbenzene,2-methylbutan-2-yl benzene,tert-amyl benzene
IUPAC Name	2-methylbutan-2-ylbenzene
InChI Key	QHTJSSMHBLGUHV-UHFFFAOYSA-N
Molecular Formula	C11H16

360

2-Phenylisobutyric Acid 98.0+%, TCI America™

CAS: 826-55-1 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.20 MDL Number: MFCD00014332 InChI Key: YYEROYLAYAVZNW-UHFFFAOYSA-N Synonym: 2-methyl-2-phenylpropionic acid,2-phenylisobutyric acid,alpha,alpha-dimethylphenylacetic acid,unii-dr8huh2gyk,dimethylphenylacetic acid,dr8huh2gyk,2-methyl-2-phenyl-propionic acid,hydratropic acid, .alpha.-methyl,benzeneacetic acid,.alpha.-dimethyl,propionic acid, 2-methyl-2-phenyl PubChem CID: 13222 IUPAC Name: 2-methyl-2-phenylpropanoic acid SMILES: CC(C)(C(O)=O)C1=CC=CC=C1

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Specifications

PubChem CID	13222
CAS	826-55-1
Molecular Weight (g/mol)	164.20
MDL Number	MFCD00014332
SMILES	CC(C)(C(O)=O)C1=CC=CC=C1
Synonym	2-methyl-2-phenylpropionic acid,2-phenylisobutyric acid,alpha,alpha-dimethylphenylacetic acid,unii-dr8huh2gyk,dimethylphenylacetic acid,dr8huh2gyk,2-methyl-2-phenyl-propionic acid,hydratropic acid, .alpha.-methyl,benzeneacetic acid,.alpha.-dimethyl,propionic acid, 2-methyl-2-phenyl
IUPAC Name	2-methyl-2-phenylpropanoic acid
InChI Key	YYEROYLAYAVZNW-UHFFFAOYSA-N
Molecular Formula	C10H12O2

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