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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1,156 – 1,170 of 1,182 results

1,156

1-(4-tert-Butylbenzyl)piperazine, 97%, Thermo Scientific™

CAS: 956-61-6 Molecular Formula: C15H24N2 Molecular Weight (g/mol): 232.37 MDL Number: MFCD00082594 InChI Key: UQLCETYSARZZSR-UHFFFAOYSA-N Synonym: 1-4-tert-butylbenzyl piperazine,1-4-tert-butyl benzyl piperazine,1-4-tert-butylphenyl methyl piperazine,piperazine, 1-4-1,1-dimethylethyl phenyl methyl,4-tert-butyl phenyl methyl piperazine,1-4-t-butylbenzyl piperazine,1-4-tert-butyl-benzyl-piperazine PubChem CID: 2735657 IUPAC Name: 1-[(4-tert-butylphenyl)methyl]piperazine SMILES: CC(C)(C)C1=CC=C(CN2CCNCC2)C=C1

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PubChem CID	2735657
CAS	956-61-6
Molecular Weight (g/mol)	232.37
MDL Number	MFCD00082594
SMILES	CC(C)(C)C1=CC=C(CN2CCNCC2)C=C1
Synonym	1-4-tert-butylbenzyl piperazine,1-4-tert-butyl benzyl piperazine,1-4-tert-butylphenyl methyl piperazine,piperazine, 1-4-1,1-dimethylethyl phenyl methyl,4-tert-butyl phenyl methyl piperazine,1-4-t-butylbenzyl piperazine,1-4-tert-butyl-benzyl-piperazine
IUPAC Name	1-[(4-tert-butylphenyl)methyl]piperazine
InChI Key	UQLCETYSARZZSR-UHFFFAOYSA-N
Molecular Formula	C15H24N2

1,157

sec-Butylbenzene, 99%

CAS: 135-98-8 Molecular Formula: C10H14 Molecular Weight (g/mol): 134.222 MDL Number: MFCD00009329 InChI Key: ZJMWRROPUADPEA-UHFFFAOYSA-N Synonym: sec-butylbenzene,2-phenylbutane,1-methylpropyl benzene,secondary butylbenzene,benzene, 1-methylpropyl,s-butylbenzene,benzene, sec-butyl,1-sec-butylbenzene,methylpropyl benzene,secbutylbenzene PubChem CID: 8680 ChEBI: CHEBI:35097 IUPAC Name: butan-2-ylbenzene SMILES: CCC(C)C1=CC=CC=C1

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PubChem CID	8680
CAS	135-98-8
Molecular Weight (g/mol)	134.222
ChEBI	CHEBI:35097
MDL Number	MFCD00009329
SMILES	CCC(C)C1=CC=CC=C1
Synonym	sec-butylbenzene,2-phenylbutane,1-methylpropyl benzene,secondary butylbenzene,benzene, 1-methylpropyl,s-butylbenzene,benzene, sec-butyl,1-sec-butylbenzene,methylpropyl benzene,secbutylbenzene
IUPAC Name	butan-2-ylbenzene
InChI Key	ZJMWRROPUADPEA-UHFFFAOYSA-N
Molecular Formula	C10H14

1,158

2-Bromo-1-phenylpropane 98%, Thermo Scientific™

CAS: 2114-39-8 Molecular Formula: C9H11Br Molecular Weight (g/mol): 199.09 MDL Number: MFCD00000149 InChI Key: NVYOCAOZCSNIHR-UHFFFAOYNA-N Synonym: 2-bromopropyl benzene,2-bromo-1-phenylpropane,1-phenyl-2-bromopropane,2-bromo-propyl-benzene,benzene, 2-bromopropyl,2-bromanylpropylbenzene,2-bromopropyl-benzene,1-2-bromopropyl benzene,acmc-1cr50 PubChem CID: 102754 IUPAC Name: (2-bromopropyl)benzene SMILES: CC(Br)CC1=CC=CC=C1

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PubChem CID	102754
CAS	2114-39-8
Molecular Weight (g/mol)	199.09
MDL Number	MFCD00000149
SMILES	CC(Br)CC1=CC=CC=C1
Synonym	2-bromopropyl benzene,2-bromo-1-phenylpropane,1-phenyl-2-bromopropane,2-bromo-propyl-benzene,benzene, 2-bromopropyl,2-bromanylpropylbenzene,2-bromopropyl-benzene,1-2-bromopropyl benzene,acmc-1cr50
IUPAC Name	(2-bromopropyl)benzene
InChI Key	NVYOCAOZCSNIHR-UHFFFAOYNA-N
Molecular Formula	C9H11Br

1,159

n-Propylbenzene, 98%

CAS: 103-65-1 Molecular Formula: C9H12 Molecular Weight (g/mol): 120.20 MDL Number: MFCD00009377 InChI Key: ODLMAHJVESYWTB-UHFFFAOYSA-N Synonym: n-propylbenzene,1-phenylpropane,phenylpropane,benzene, propyl,1-propylbenzene,isocumene,n-propyl benzene,propyl-benzene,unii-0wr86zhg2z,propylbenzene, n PubChem CID: 7668 ChEBI: CHEBI:42630 IUPAC Name: propylbenzene SMILES: CCCC1=CC=CC=C1

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Specifications

PubChem CID	7668
CAS	103-65-1
Molecular Weight (g/mol)	120.20
ChEBI	CHEBI:42630
MDL Number	MFCD00009377
SMILES	CCCC1=CC=CC=C1
Synonym	n-propylbenzene,1-phenylpropane,phenylpropane,benzene, propyl,1-propylbenzene,isocumene,n-propyl benzene,propyl-benzene,unii-0wr86zhg2z,propylbenzene, n
IUPAC Name	propylbenzene
InChI Key	ODLMAHJVESYWTB-UHFFFAOYSA-N
Molecular Formula	C9H12

1,160

3-(2-Hydroxy-2-propanyl)phenylboronic acid pinacol ester, 97%, Thermo Scientific™

CAS: 1309980-11-7 InChI Key: NNPQWBXXZHNLAW-UHFFFAOYSA-N Synonym: 2-3-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl propan-2-ol,3-2-hydroxypropan-2-yl phenylboronic acid pinacol ester,3-2-hydroxy-2-propyl phenylboronic acid pinacol ester,3-2-hydroxy-2-propanyl phenylboronic acid pinacol ester,3-2-hydroxypropan-2-yl phenyl boronic acid pinacol ester,2-3-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl phenyl propan-2-ol,2-3-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl propan-2-ol PubChem CID: 46738028 IUPAC Name: 2-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]propan-2-ol SMILES: B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC=C2)C(C)(C)O

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PubChem CID	46738028
CAS	1309980-11-7
SMILES	B1(OC(C(O1)(C)C)(C)C)C2=CC(=CC=C2)C(C)(C)O
Synonym	2-3-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl propan-2-ol,3-2-hydroxypropan-2-yl phenylboronic acid pinacol ester,3-2-hydroxy-2-propyl phenylboronic acid pinacol ester,3-2-hydroxy-2-propanyl phenylboronic acid pinacol ester,3-2-hydroxypropan-2-yl phenyl boronic acid pinacol ester,2-3-4,4,5,5-tetramethyl-1,3,2 dioxaborolan-2-yl phenyl propan-2-ol,2-3-tetramethyl-1,3,2-dioxaborolan-2-yl phenyl propan-2-ol
IUPAC Name	2-[3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]propan-2-ol
InChI Key	NNPQWBXXZHNLAW-UHFFFAOYSA-N

1,161

3-tert-Butyltoluene, 99%, Thermo Scientific™

CAS: 1075-38-3 Molecular Formula: C11H16 Molecular Weight (g/mol): 148.249 MDL Number: MFCD00059210 InChI Key: JTIAYWZZZOZUTK-UHFFFAOYSA-N Synonym: 3-tert-butyltoluene,toluene, m-tert-butyl,benzene, 1-1,1-dimethylethyl-3-methyl,1-tert-butyl-3-methylbenzene,m-tert-butyltoluene,1-methyl-3-tert-butylbenzene,butyltoluol,acmc-1bo1t,1-methyl-3-tert-butyl-benzene,jtiaywzzzozutk-uhfffaoysa PubChem CID: 33711 IUPAC Name: 1-tert-butyl-3-methylbenzene SMILES: CC1=CC(=CC=C1)C(C)(C)C

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PubChem CID	33711
CAS	1075-38-3
Molecular Weight (g/mol)	148.249
MDL Number	MFCD00059210
SMILES	CC1=CC(=CC=C1)C(C)(C)C
Synonym	3-tert-butyltoluene,toluene, m-tert-butyl,benzene, 1-1,1-dimethylethyl-3-methyl,1-tert-butyl-3-methylbenzene,m-tert-butyltoluene,1-methyl-3-tert-butylbenzene,butyltoluol,acmc-1bo1t,1-methyl-3-tert-butyl-benzene,jtiaywzzzozutk-uhfffaoysa
IUPAC Name	1-tert-butyl-3-methylbenzene
InChI Key	JTIAYWZZZOZUTK-UHFFFAOYSA-N
Molecular Formula	C11H16

1,162

(1S,2R)-1-Phenyl-2-(1-pyrrolidinyl)-1-propanol, Thermo Scientific™

CAS: 123620-80-4 Molecular Formula: C13H19NO Molecular Weight (g/mol): 205.30 MDL Number: MFCD02093492 InChI Key: FZVHJGJBJLFWEX-UHFFFAOYNA-N Synonym: 1s,2r-1-phenyl-2-pyrrolidin-1-yl propan-1-ol,1s,2r-1-phenyl-2-1-pyrrolidinyl propan-1-ol,1s,2r-1-phenyl-2-pyrrolidin-1-yl-propan-1-ol,1s,2r-1-phenyl-2-1-pyrrolidinyl-1-propanol,1s,2r-n,n-tetramethylenenorephedrine,1-phenyl-2-pyrrolidin-1-yl propan-1-ol, 1s,2r,1-pyrrolidineethanol, beta-methyl-alpha-phenyl-, alphas,betar,pubchem8276,pubchem14465,1s,2r-1-phenyl-2-pyrrolizino-1-propanol PubChem CID: 9942483 IUPAC Name: 1-phenyl-2-(pyrrolidin-1-yl)propan-1-ol SMILES: CC(C(O)C1=CC=CC=C1)N1CCCC1

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Specifications

PubChem CID	9942483
CAS	123620-80-4
Molecular Weight (g/mol)	205.30
MDL Number	MFCD02093492
SMILES	CC(C(O)C1=CC=CC=C1)N1CCCC1
Synonym	1s,2r-1-phenyl-2-pyrrolidin-1-yl propan-1-ol,1s,2r-1-phenyl-2-1-pyrrolidinyl propan-1-ol,1s,2r-1-phenyl-2-pyrrolidin-1-yl-propan-1-ol,1s,2r-1-phenyl-2-1-pyrrolidinyl-1-propanol,1s,2r-n,n-tetramethylenenorephedrine,1-phenyl-2-pyrrolidin-1-yl propan-1-ol, 1s,2r,1-pyrrolidineethanol, beta-methyl-alpha-phenyl-, alphas,betar,pubchem8276,pubchem14465,1s,2r-1-phenyl-2-pyrrolizino-1-propanol
IUPAC Name	1-phenyl-2-(pyrrolidin-1-yl)propan-1-ol
InChI Key	FZVHJGJBJLFWEX-UHFFFAOYNA-N
Molecular Formula	C13H19NO

1,163

2-Fluorophenylacetone, 99%, Thermo Scientific™

CAS: 2836-82-0 Molecular Formula: C9H9FO Molecular Weight (g/mol): 152.168 InChI Key: BANVZEUCJHUPOI-UHFFFAOYSA-N Synonym: 2-fluorophenylacetone,1-2-fluorophenyl propan-2-one,1-2-fluorophenyl acetone,2-fluorophenyl acetone,o-fluorophenylacetone,2-propanone, 1-2-fluorophenyl,acmc-20anub,ksc497e4p,1-2-fluorophenyl acetone # PubChem CID: 76086 IUPAC Name: 1-(2-fluorophenyl)propan-2-one SMILES: CC(=O)CC1=CC=CC=C1F

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Specifications

PubChem CID	76086
CAS	2836-82-0
Molecular Weight (g/mol)	152.168
SMILES	CC(=O)CC1=CC=CC=C1F
Synonym	2-fluorophenylacetone,1-2-fluorophenyl propan-2-one,1-2-fluorophenyl acetone,2-fluorophenyl acetone,o-fluorophenylacetone,2-propanone, 1-2-fluorophenyl,acmc-20anub,ksc497e4p,1-2-fluorophenyl acetone #
IUPAC Name	1-(2-fluorophenyl)propan-2-one
InChI Key	BANVZEUCJHUPOI-UHFFFAOYSA-N
Molecular Formula	C9H9FO

1,164

1-(4-Fluorophenyl)-2-propylamine, 97%, Thermo Scientific™

CAS: 459-02-9 Molecular Formula: C9H13ClFN Molecular Weight (g/mol): 189.66 MDL Number: MFCD01708101 InChI Key: GKWYMWZWSCKSMT-UHFFFAOYNA-N Synonym: 4-fluoroamphetamine,p-fluoroamphetamine,1-4-fluorophenyl propan-2-amine,1-4-fluorophenyl propane-2-amine,+--p-fluoroamphetamine,2-4-fluoro-phenyl-1-methyl-ethylamine,p-fluoro-alpha-methylphenethylamine,4-fluoro-alpha-methylphenethylamine,benzeneethanamine, p-fluoro-alpha-methyl,1-4-fluorophenyl-2-propylamine PubChem CID: 9986 IUPAC Name: hydrogen 1-(4-fluorophenyl)propan-2-amine chloride SMILES: [H+].[Cl-].CC(N)CC1=CC=C(F)C=C1

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PubChem CID	9986
CAS	459-02-9
Molecular Weight (g/mol)	189.66
MDL Number	MFCD01708101
SMILES	[H+].[Cl-].CC(N)CC1=CC=C(F)C=C1
Synonym	4-fluoroamphetamine,p-fluoroamphetamine,1-4-fluorophenyl propan-2-amine,1-4-fluorophenyl propane-2-amine,+--p-fluoroamphetamine,2-4-fluoro-phenyl-1-methyl-ethylamine,p-fluoro-alpha-methylphenethylamine,4-fluoro-alpha-methylphenethylamine,benzeneethanamine, p-fluoro-alpha-methyl,1-4-fluorophenyl-2-propylamine
IUPAC Name	hydrogen 1-(4-fluorophenyl)propan-2-amine chloride
InChI Key	GKWYMWZWSCKSMT-UHFFFAOYNA-N
Molecular Formula	C9H13ClFN

1,165

2-Methyl-1-phenyl-2-propanol 99%, Thermo Scientific™

CAS: 100-86-7 Molecular Formula: C10H14O Molecular Weight (g/mol): 150.221 MDL Number: MFCD00004465 InChI Key: RIWRBSMFKVOJMN-UHFFFAOYSA-N Synonym: 2-methyl-1-phenyl-2-propanol,benzyldimethylcarbinol,2-benzyl-2-propanol,phenyl-tert-butanol,dimethylbenzylcarbinol,dmbc,1,1-dimethylphenylethanol,1,1-dimethyl-2-phenylethanol,benzylpropyl alcohol,dimethyl benzyl carbinol PubChem CID: 7531 IUPAC Name: 2-methyl-1-phenylpropan-2-ol SMILES: CC(C)(CC1=CC=CC=C1)O

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PubChem CID	7531
CAS	100-86-7
Molecular Weight (g/mol)	150.221
MDL Number	MFCD00004465
SMILES	CC(C)(CC1=CC=CC=C1)O
Synonym	2-methyl-1-phenyl-2-propanol,benzyldimethylcarbinol,2-benzyl-2-propanol,phenyl-tert-butanol,dimethylbenzylcarbinol,dmbc,1,1-dimethylphenylethanol,1,1-dimethyl-2-phenylethanol,benzylpropyl alcohol,dimethyl benzyl carbinol
IUPAC Name	2-methyl-1-phenylpropan-2-ol
InChI Key	RIWRBSMFKVOJMN-UHFFFAOYSA-N
Molecular Formula	C10H14O

1,166

3-Fluorophenylacetone, 97%, Thermo Scientific™

CAS: 1737-19-5 Molecular Formula: C9H9FO Molecular Weight (g/mol): 152.168 MDL Number: MFCD00061144 InChI Key: UWCPYXSRCQVABG-UHFFFAOYSA-N Synonym: 3-fluorophenylacetone,1-3-fluorophenyl propan-2-one,1-3-fluorophenyl acetone,acmc-1bqff,m-fluorophenyl-2-propanone,1-3-fluorophenyl acetone #,1-3-fluorophenyl-2-propanone PubChem CID: 137185 IUPAC Name: 1-(3-fluorophenyl)propan-2-one SMILES: CC(=O)CC1=CC(=CC=C1)F

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PubChem CID	137185
CAS	1737-19-5
Molecular Weight (g/mol)	152.168
MDL Number	MFCD00061144
SMILES	CC(=O)CC1=CC(=CC=C1)F
Synonym	3-fluorophenylacetone,1-3-fluorophenyl propan-2-one,1-3-fluorophenyl acetone,acmc-1bqff,m-fluorophenyl-2-propanone,1-3-fluorophenyl acetone #,1-3-fluorophenyl-2-propanone
IUPAC Name	1-(3-fluorophenyl)propan-2-one
InChI Key	UWCPYXSRCQVABG-UHFFFAOYSA-N
Molecular Formula	C9H9FO

1,167

3,5-Di-tert-butyl-4-hydroxybenzoic acid, 98%

CAS: 1421-49-4 Molecular Formula: C30H42NiO6 Molecular Weight (g/mol): 557.35 MDL Number: MFCD00008827 InChI Key: VIUVLVWUWLHYGT-UHFFFAOYSA-L Synonym: 3,5-di-tert-butyl-4-hydroxybenzoic acid,benzoic acid, 3,5-bis 1,1-dimethylethyl-4-hydroxy,unii-9f0i7yag34,3,5-di-t-butyl-4-hydroxybenzoic acid,3,5-bis-tert-butyl-4-hydroxybenzoic acid,benzoic acid, 3,5-di-tert-butyl-4-hydroxy,3,5-di tert-butyl-4-hydroxybenzoic acid,3,5-di-tert-butyl-4-hydroxy benzoic acid,3,5-bis tert-butyl-4-hydroxybenzoic acid,pubchem15681 PubChem CID: 15007 IUPAC Name: 3,5-ditert-butyl-4-hydroxybenzoic acid SMILES: [Ni++].CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C([O-])=O.CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C([O-])=O

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Specifications

PubChem CID	15007
CAS	1421-49-4
Molecular Weight (g/mol)	557.35
MDL Number	MFCD00008827
SMILES	[Ni++].CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C([O-])=O.CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C([O-])=O
Synonym	3,5-di-tert-butyl-4-hydroxybenzoic acid,benzoic acid, 3,5-bis 1,1-dimethylethyl-4-hydroxy,unii-9f0i7yag34,3,5-di-t-butyl-4-hydroxybenzoic acid,3,5-bis-tert-butyl-4-hydroxybenzoic acid,benzoic acid, 3,5-di-tert-butyl-4-hydroxy,3,5-di tert-butyl-4-hydroxybenzoic acid,3,5-di-tert-butyl-4-hydroxy benzoic acid,3,5-bis tert-butyl-4-hydroxybenzoic acid,pubchem15681
IUPAC Name	3,5-ditert-butyl-4-hydroxybenzoic acid
InChI Key	VIUVLVWUWLHYGT-UHFFFAOYSA-L
Molecular Formula	C30H42NiO6

1,168

4-n-Propylbenzoic acid, 98+%, Thermo Scientific™

CAS: 2438-05-3 Molecular Formula: C10H11O2 Molecular Weight (g/mol): 163.20 MDL Number: MFCD00013996 InChI Key: ATZHGRNFEFVDDJ-UHFFFAOYSA-M Synonym: 4-n-propylbenzoic acid,benzoic acid, 4-propyl,4-propyl-benzoic acid,p-n-propyl benzoic acid,p-propylbenzoic acid,unii-3p1v85e45o,4-propylbenzoicacid,p-propyl benzoic acid,4-propylbenzolic acid,pubchem1348 PubChem CID: 137601 IUPAC Name: 4-propylbenzoic acid SMILES: CCCC1=CC=C(C=C1)C(=O)O

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Specifications

PubChem CID	137601
CAS	2438-05-3
Molecular Weight (g/mol)	163.20
MDL Number	MFCD00013996
SMILES	CCCC1=CC=C(C=C1)C(=O)O
Synonym	4-n-propylbenzoic acid,benzoic acid, 4-propyl,4-propyl-benzoic acid,p-n-propyl benzoic acid,p-propylbenzoic acid,unii-3p1v85e45o,4-propylbenzoicacid,p-propyl benzoic acid,4-propylbenzolic acid,pubchem1348
IUPAC Name	4-propylbenzoic acid
InChI Key	ATZHGRNFEFVDDJ-UHFFFAOYSA-M
Molecular Formula	C10H11O2

1,169

MP Biomedicals, Inc Butylhydroxytoluene, 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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Specifications

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

1,170

1-Methyl-2-phenylethyl Acetate 95.0+%, TCI America™

CAS: 2114-33-2 Molecular Formula: C11H14O2 Molecular Weight (g/mol): 178.231 MDL Number: MFCD01672540 InChI Key: LOHDWLZDQXQLJA-UHFFFAOYSA-N Synonym: Acetic Acid 1-Methyl-2-phenylethyl Ester, 2-Acetoxy-1-phenylpropane PubChem CID: 16457 IUPAC Name: 1-phenylpropan-2-yl acetate SMILES: CC(CC1=CC=CC=C1)OC(=O)C

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Specifications

PubChem CID	16457
CAS	2114-33-2
Molecular Weight (g/mol)	178.231
MDL Number	MFCD01672540
SMILES	CC(CC1=CC=CC=C1)OC(=O)C
Synonym	Acetic Acid 1-Methyl-2-phenylethyl Ester, 2-Acetoxy-1-phenylpropane
IUPAC Name	1-phenylpropan-2-yl acetate
InChI Key	LOHDWLZDQXQLJA-UHFFFAOYSA-N
Molecular Formula	C11H14O2

Phenylpropanes

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