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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181 – 195 of 707 results

181

3-Chlorophenylacetone, 94%

CAS: 14123-60-5 Molecular Formula: C9H9ClO Molecular Weight (g/mol): 168.62 MDL Number: MFCD00082872 InChI Key: VCNYPJMEQHTAHS-UHFFFAOYSA-N PubChem CID: 2734097 IUPAC Name: 1-(3-chlorophenyl)propan-2-one SMILES: CC(=O)CC1=CC=CC(Cl)=C1

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PubChem CID	2734097
CAS	14123-60-5
Molecular Weight (g/mol)	168.62
MDL Number	MFCD00082872
SMILES	CC(=O)CC1=CC=CC(Cl)=C1
IUPAC Name	1-(3-chlorophenyl)propan-2-one
InChI Key	VCNYPJMEQHTAHS-UHFFFAOYSA-N
Molecular Formula	C9H9ClO

182

1-(4-Fluorophenyl)-1-methylethylamine, 97%

CAS: 17797-10-3 Molecular Formula: C9H12FN Molecular Weight (g/mol): 153.20 MDL Number: MFCD07777176 InChI Key: NYFSRXOWJXAHOO-UHFFFAOYSA-N Synonym: 2-4-fluorophenyl propan-2-amine,1-4-fluorophenyl-1-methylethylamine,1-4-fluorophenyl-1-methyl-ethylamine,1-4-fluoro-phenyl-1-methyl-ethylamine,2-4-fluorophenyl prop-2-ylamine,1-methyl-1-4-fluorophenyl ethylamine,4-fluorocumylamine,pubchem16914,4-fluoro-alpha,alpha-dimethylbenzylamine,alpha,alpha-dimethyl-4-fluorobenzylamine PubChem CID: 13025665 IUPAC Name: 2-(4-fluorophenyl)propan-2-amine SMILES: CC(C)(N)C1=CC=C(F)C=C1

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PubChem CID	13025665
CAS	17797-10-3
Molecular Weight (g/mol)	153.20
MDL Number	MFCD07777176
SMILES	CC(C)(N)C1=CC=C(F)C=C1
Synonym	2-4-fluorophenyl propan-2-amine,1-4-fluorophenyl-1-methylethylamine,1-4-fluorophenyl-1-methyl-ethylamine,1-4-fluoro-phenyl-1-methyl-ethylamine,2-4-fluorophenyl prop-2-ylamine,1-methyl-1-4-fluorophenyl ethylamine,4-fluorocumylamine,pubchem16914,4-fluoro-alpha,alpha-dimethylbenzylamine,alpha,alpha-dimethyl-4-fluorobenzylamine
IUPAC Name	2-(4-fluorophenyl)propan-2-amine
InChI Key	NYFSRXOWJXAHOO-UHFFFAOYSA-N
Molecular Formula	C9H12FN

183

1-Phenyl-1,2-propanedione-2-oxime, 99%

CAS: 119-51-7 Molecular Formula: C9H9NO2 Molecular Weight (g/mol): 163.18 MDL Number: MFCD00002115 InChI Key: YPINLRNGSGGJJT-JXMROGBWSA-N Synonym: 1-phenyl-1,2-propanedione-2-oxime,2-hydroxyimino propiophenone,isonitrosopropiophenone,2-hydroxyiminopropiophenone,2-hydroxyimino-1-phenylpropan-1-one,propiophenone, isonitroso,2-isonitrosopropiophenone,alpha-oximinopropiophenone,1-phenyl-1,2-propanedione 2-oxime,.alpha.-oximinopropiophenone PubChem CID: 9566063 IUPAC Name: (2E)-2-hydroxyimino-1-phenylpropan-1-one SMILES: C\C(=N/O)C(=O)C1=CC=CC=C1

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Specifications

PubChem CID	9566063
CAS	119-51-7
Molecular Weight (g/mol)	163.18
MDL Number	MFCD00002115
SMILES	C\C(=N/O)C(=O)C1=CC=CC=C1
Synonym	1-phenyl-1,2-propanedione-2-oxime,2-hydroxyimino propiophenone,isonitrosopropiophenone,2-hydroxyiminopropiophenone,2-hydroxyimino-1-phenylpropan-1-one,propiophenone, isonitroso,2-isonitrosopropiophenone,alpha-oximinopropiophenone,1-phenyl-1,2-propanedione 2-oxime,.alpha.-oximinopropiophenone
IUPAC Name	(2E)-2-hydroxyimino-1-phenylpropan-1-one
InChI Key	YPINLRNGSGGJJT-JXMROGBWSA-N
Molecular Formula	C9H9NO2

184

3-tert-Butylphenol, 99%

CAS: 585-34-2 Molecular Formula: C10H14O Molecular Weight (g/mol): 150.22 MDL Number: MFCD00002300 InChI Key: CYEKUDPFXBLGHH-UHFFFAOYSA-N Synonym: m-tert-butylphenol,phenol, 3-1,1-dimethylethyl,3-t-butylphenol,3-tert-butyl phenol,phenol, m-tert-butyl,3-tert-butyl-phenol,3-tertbutylphenol,3-tert.butylphenol,m-tert.-butylphenol PubChem CID: 11450 ChEBI: CHEBI:34348 IUPAC Name: 3-tert-butylphenol SMILES: CC(C)(C)C1=CC=CC(O)=C1

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PubChem CID	11450
CAS	585-34-2
Molecular Weight (g/mol)	150.22
ChEBI	CHEBI:34348
MDL Number	MFCD00002300
SMILES	CC(C)(C)C1=CC=CC(O)=C1
Synonym	m-tert-butylphenol,phenol, 3-1,1-dimethylethyl,3-t-butylphenol,3-tert-butyl phenol,phenol, m-tert-butyl,3-tert-butyl-phenol,3-tertbutylphenol,3-tert.butylphenol,m-tert.-butylphenol
IUPAC Name	3-tert-butylphenol
InChI Key	CYEKUDPFXBLGHH-UHFFFAOYSA-N
Molecular Formula	C10H14O

185

2-Methoxyphenylacetone, 97%

CAS: 5211-62-1 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.204 MDL Number: MFCD00008770 InChI Key: GMBFNZCPZFVKAT-UHFFFAOYSA-N Synonym: 2-methoxyphenylacetone,1-2-methoxyphenyl propan-2-one,1-2-methoxyphenyl acetone,o-anisylacetone,o-methoxy phenyl acetone,2-acetonylanisole,o-methoxyphenylaceton,2-propanone, 1-2-methoxyphenyl,2-methoxyphenyl acetone,pubchem23387 PubChem CID: 78887 IUPAC Name: 1-(2-methoxyphenyl)propan-2-one SMILES: CC(=O)CC1=CC=CC=C1OC

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Specifications

PubChem CID	78887
CAS	5211-62-1
Molecular Weight (g/mol)	164.204
MDL Number	MFCD00008770
SMILES	CC(=O)CC1=CC=CC=C1OC
Synonym	2-methoxyphenylacetone,1-2-methoxyphenyl propan-2-one,1-2-methoxyphenyl acetone,o-anisylacetone,o-methoxy phenyl acetone,2-acetonylanisole,o-methoxyphenylaceton,2-propanone, 1-2-methoxyphenyl,2-methoxyphenyl acetone,pubchem23387
IUPAC Name	1-(2-methoxyphenyl)propan-2-one
InChI Key	GMBFNZCPZFVKAT-UHFFFAOYSA-N
Molecular Formula	C10H12O2

186

4-tert-Butylphenyl glycidyl ether, 95%

CAS: 3101-60-8 Molecular Formula: C13H18O2 Molecular Weight (g/mol): 206.285 MDL Number: MFCD00005136 InChI Key: HHRACYLRBOUBKM-UHFFFAOYSA-N Synonym: p-tert-butylphenyl glycidyl ether,4-tert-butylphenyl glycidyl ether,4-t-butylphenyl glycidyl ether,2-4-tert-butylphenoxy methyl oxirane,tert-butylphenol glycidyl ether,tert-butylphenyl glycidyl ether,t-butyl phenyl glycidyl ether,ccris 2638,oxirane, 4-1,1-dimethylethyl phenoxy methyl,2-4-tert-butyl phenoxy methyl oxirane PubChem CID: 18360 IUPAC Name: 2-[(4-tert-butylphenoxy)methyl]oxirane SMILES: CC(C)(C)C1=CC=C(C=C1)OCC2CO2

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Specifications

PubChem CID	18360
CAS	3101-60-8
Molecular Weight (g/mol)	206.285
MDL Number	MFCD00005136
SMILES	CC(C)(C)C1=CC=C(C=C1)OCC2CO2
Synonym	p-tert-butylphenyl glycidyl ether,4-tert-butylphenyl glycidyl ether,4-t-butylphenyl glycidyl ether,2-4-tert-butylphenoxy methyl oxirane,tert-butylphenol glycidyl ether,tert-butylphenyl glycidyl ether,t-butyl phenyl glycidyl ether,ccris 2638,oxirane, 4-1,1-dimethylethyl phenoxy methyl,2-4-tert-butyl phenoxy methyl oxirane
IUPAC Name	2-[(4-tert-butylphenoxy)methyl]oxirane
InChI Key	HHRACYLRBOUBKM-UHFFFAOYSA-N
Molecular Formula	C13H18O2

187

Probucol, 99.7%, MP Biomedicals™

CAS: 23288-49-5 Molecular Formula: C31H48O2S2 Molecular Weight (g/mol): 516.843 InChI Key: FYPMFJGVHOHGLL-UHFFFAOYSA-N Synonym: probucol,lorelco,biphenabid,bisphenabid,lurselle,bisbid,lesterol,lursell,panavir,probucolum PubChem CID: 4912 ChEBI: CHEBI:8427 IUPAC Name: 2,6-ditert-butyl-4-[2-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanylpropan-2-ylsulfanyl]phenol SMILES: CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SC(C)(C)SC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

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Specifications

PubChem CID	4912
CAS	23288-49-5
Molecular Weight (g/mol)	516.843
ChEBI	CHEBI:8427
SMILES	CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SC(C)(C)SC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C
Synonym	probucol,lorelco,biphenabid,bisphenabid,lurselle,bisbid,lesterol,lursell,panavir,probucolum
IUPAC Name	2,6-ditert-butyl-4-[2-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanylpropan-2-ylsulfanyl]phenol
InChI Key	FYPMFJGVHOHGLL-UHFFFAOYSA-N
Molecular Formula	C31H48O2S2

188

Butylated Hydroxytoluene Crystalline MP Biomedicals

CAS: 128-37-0 Molecular Formula: C15H24O Molecular Weight (g/mol): 220.356 InChI Key: NLZUEZXRPGMBCV-UHFFFAOYSA-N Synonym: 2,6-di-tert-butyl-4-methylphenol,butylated hydroxytoluene,butylhydroxytoluene,2,6-di-tert-butyl-p-cresol,2,6-di-t-butyl-4-methylphenol,ionol,dbpc,dibunol,stavox,bht PubChem CID: 31404 ChEBI: CHEBI:34247 IUPAC Name: 2,6-ditert-butyl-4-methylphenol SMILES: CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C

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PubChem CID	31404
CAS	128-37-0
Molecular Weight (g/mol)	220.356
ChEBI	CHEBI:34247
SMILES	CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C
Synonym	2,6-di-tert-butyl-4-methylphenol,butylated hydroxytoluene,butylhydroxytoluene,2,6-di-tert-butyl-p-cresol,2,6-di-t-butyl-4-methylphenol,ionol,dbpc,dibunol,stavox,bht
IUPAC Name	2,6-ditert-butyl-4-methylphenol
InChI Key	NLZUEZXRPGMBCV-UHFFFAOYSA-N
Molecular Formula	C15H24O

189

Linear alkylbenzenesulfonic acid, 97%

CAS: 68584-22-5 Molecular Formula: C18H30O3S Molecular Weight (g/mol): 326.495 MDL Number: MFCD00147445 InChI Key: QJRVOJKLQNSNDB-UHFFFAOYSA-N Synonym: p-3-dodecyl benzenesulphonic acid,c10-c16 alkylbenzenesulfonic acid,3-4-sulfophenyl dodecane,benzenesulfonic acid, 4-1-ethyldecyl,benzenesulfonic acid, c10-16-alkyl derivs.,dsstox_cid_7923,4-dodecan-3-yl benzenesulfonic acid,c10-c16 alkyl benzene sulfonic acid PubChem CID: 29249 IUPAC Name: 4-dodecan-3-ylbenzenesulfonic acid SMILES: CCCCCCCCCC(CC)C1=CC=C(C=C1)S(=O)(=O)O

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PubChem CID	29249
CAS	68584-22-5
Molecular Weight (g/mol)	326.495
MDL Number	MFCD00147445
SMILES	CCCCCCCCCC(CC)C1=CC=C(C=C1)S(=O)(=O)O
Synonym	p-3-dodecyl benzenesulphonic acid,c10-c16 alkylbenzenesulfonic acid,3-4-sulfophenyl dodecane,benzenesulfonic acid, 4-1-ethyldecyl,benzenesulfonic acid, c10-16-alkyl derivs.,dsstox_cid_7923,4-dodecan-3-yl benzenesulfonic acid,c10-c16 alkyl benzene sulfonic acid
IUPAC Name	4-dodecan-3-ylbenzenesulfonic acid
InChI Key	QJRVOJKLQNSNDB-UHFFFAOYSA-N
Molecular Formula	C18H30O3S

190

4-(1,1,3,3-Tetramethylbutyl)phenol 95.0+%, TCI America™

CAS: 140-66-9 Molecular Formula: C14H22O Molecular Weight (g/mol): 206.329 MDL Number: MFCD00002368 InChI Key: ISAVYTVYFVQUDY-UHFFFAOYSA-N Synonym: 4-tert-octylphenol,p-tert-octylphenol,4-t-octylphenol,4-1,1,3,3-tetramethylbutyl phenol,4-2,4,4-trimethylpentan-2-yl phenol,p-terc.oktylfenol,para-tert-octylphenol,p-1,1,3,3-tetramethylbutyl phenol,phenol, 4-1,1,3,3-tetramethylbutyl,phenol, p-tert-octyl PubChem CID: 8814 ChEBI: CHEBI:34445 IUPAC Name: 4-(2,4,4-trimethylpentan-2-yl)phenol SMILES: CC(C)(C)CC(C)(C)C1=CC=C(C=C1)O

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Specifications

PubChem CID	8814
CAS	140-66-9
Molecular Weight (g/mol)	206.329
ChEBI	CHEBI:34445
MDL Number	MFCD00002368
SMILES	CC(C)(C)CC(C)(C)C1=CC=C(C=C1)O
Synonym	4-tert-octylphenol,p-tert-octylphenol,4-t-octylphenol,4-1,1,3,3-tetramethylbutyl phenol,4-2,4,4-trimethylpentan-2-yl phenol,p-terc.oktylfenol,para-tert-octylphenol,p-1,1,3,3-tetramethylbutyl phenol,phenol, 4-1,1,3,3-tetramethylbutyl,phenol, p-tert-octyl
IUPAC Name	4-(2,4,4-trimethylpentan-2-yl)phenol
InChI Key	ISAVYTVYFVQUDY-UHFFFAOYSA-N
Molecular Formula	C14H22O

191

trans-2-[3-(4-tert-Butylphenyl)-2-methyl-2-propenylidene]malononitrile 98.0+%, TCI America™

CAS: 300364-84-5 Molecular Formula: C17H18N2 Molecular Weight (g/mol): 250.345 MDL Number: MFCD03453260 InChI Key: OIASAVWSBWJWBR-UKTHLTGXSA-N Synonym: DCTB PubChem CID: 6382826 ChEBI: CHEBI:64343 IUPAC Name: 2-[(E)-3-(4-tert-butylphenyl)-2-methylprop-2-enylidene]propanedinitrile SMILES: CC(=CC1=CC=C(C=C1)C(C)(C)C)C=C(C#N)C#N

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Specifications

PubChem CID	6382826
CAS	300364-84-5
Molecular Weight (g/mol)	250.345
ChEBI	CHEBI:64343
MDL Number	MFCD03453260
SMILES	CC(=CC1=CC=C(C=C1)C(C)(C)C)C=C(C#N)C#N
Synonym	DCTB
IUPAC Name	2-[(E)-3-(4-tert-butylphenyl)-2-methylprop-2-enylidene]propanedinitrile
InChI Key	OIASAVWSBWJWBR-UKTHLTGXSA-N
Molecular Formula	C17H18N2

192

2-(2-Hydroxy-5-tert-octylphenyl)benzotriazole 98.0+%, TCI America™

CAS: 3147-75-9 Molecular Formula: C20H25N3O Molecular Weight (g/mol): 323.44 MDL Number: MFCD00013338 InChI Key: IYAZLDLPUNDVAG-UHFFFAOYSA-N PubChem CID: 62485 IUPAC Name: 2-(2H-1,2,3-benzotriazol-2-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol SMILES: CC(C)(C)CC(C)(C)C1=CC=C(O)C(=C1)N1N=C2C=CC=CC2=N1

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PubChem CID	62485
CAS	3147-75-9
Molecular Weight (g/mol)	323.44
MDL Number	MFCD00013338
SMILES	CC(C)(C)CC(C)(C)C1=CC=C(O)C(=C1)N1N=C2C=CC=CC2=N1
IUPAC Name	2-(2H-1,2,3-benzotriazol-2-yl)-4-(2,4,4-trimethylpentan-2-yl)phenol
InChI Key	IYAZLDLPUNDVAG-UHFFFAOYSA-N
Molecular Formula	C20H25N3O

193

4-tert-Butylphthalonitrile 98.0+%, TCI America™

CAS: 32703-80-3 Molecular Formula: C12H12N2 Molecular Weight (g/mol): 184.242 MDL Number: MFCD00060112 InChI Key: LOTMIRVNJTVTSU-UHFFFAOYSA-N Synonym: 4-tert-Butyl-1,2-dicyanobenzene PubChem CID: 122931 IUPAC Name: 4-tert-butylbenzene-1,2-dicarbonitrile SMILES: CC(C)(C)C1=CC(=C(C=C1)C#N)C#N

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PubChem CID	122931
CAS	32703-80-3
Molecular Weight (g/mol)	184.242
MDL Number	MFCD00060112
SMILES	CC(C)(C)C1=CC(=C(C=C1)C#N)C#N
Synonym	4-tert-Butyl-1,2-dicyanobenzene
IUPAC Name	4-tert-butylbenzene-1,2-dicarbonitrile
InChI Key	LOTMIRVNJTVTSU-UHFFFAOYSA-N
Molecular Formula	C12H12N2

194

Diethylstilbestrol 98.0+%, TCI America™

CAS: 6898-97-1 Molecular Formula: C18H20O2 Molecular Weight (g/mol): 268.36 MDL Number: MFCD00002373 InChI Key: RGLYKWWBQGJZGM-ISLYRVAYSA-N Synonym: Stilbestrol PubChem CID: 688057 IUPAC Name: 4-[(3E)-4-(4-hydroxyphenyl)hex-3-en-3-yl]phenol SMILES: CC\C(=C(\CC)C1=CC=C(O)C=C1)C1=CC=C(O)C=C1

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Specifications

PubChem CID	688057
CAS	6898-97-1
Molecular Weight (g/mol)	268.36
MDL Number	MFCD00002373
SMILES	CC\C(=C(\CC)C1=CC=C(O)C=C1)C1=CC=C(O)C=C1
Synonym	Stilbestrol
IUPAC Name	4-[(3E)-4-(4-hydroxyphenyl)hex-3-en-3-yl]phenol
InChI Key	RGLYKWWBQGJZGM-ISLYRVAYSA-N
Molecular Formula	C18H20O2

195

4-tert-Butylphenol 98.0+%, TCI America™

CAS: 98-54-4 Molecular Formula: C10H14O Molecular Weight (g/mol): 150.221 MDL Number: MFCD00002367 InChI Key: QHPQWRBYOIRBIT-UHFFFAOYSA-N Synonym: 4-tert-butyl phenol,butylphen,p-tert-butylphenol,ptbp,4-1,1-dimethylethyl phenol,4-t-butylphenol,p-t-butyl phenol,phenol, 4-1,1-dimethylethyl,p-t-butylphenol,p-terc.butylfenol PubChem CID: 7393 ChEBI: CHEBI:34444 IUPAC Name: 4-tert-butylphenol SMILES: CC(C)(C)C1=CC=C(C=C1)O

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Specifications

PubChem CID	7393
CAS	98-54-4
Molecular Weight (g/mol)	150.221
ChEBI	CHEBI:34444
MDL Number	MFCD00002367
SMILES	CC(C)(C)C1=CC=C(C=C1)O
Synonym	4-tert-butyl phenol,butylphen,p-tert-butylphenol,ptbp,4-1,1-dimethylethyl phenol,4-t-butylphenol,p-t-butyl phenol,phenol, 4-1,1-dimethylethyl,p-t-butylphenol,p-terc.butylfenol
IUPAC Name	4-tert-butylphenol
InChI Key	QHPQWRBYOIRBIT-UHFFFAOYSA-N
Molecular Formula	C10H14O

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