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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241 – 255 of 1,182 results

241

1-Phenyl-2-propanol 98.0+%, TCI America™

CAS: 698-87-3 Molecular Formula: C9H12O Molecular Weight (g/mol): 136.19 MDL Number: MFCD00004540 InChI Key: WYTRYIUQUDTGSX-UHFFFAOYNA-N Synonym: Benzylmethylcarbinol PubChem CID: 94185 IUPAC Name: 1-phenylpropan-2-ol SMILES: CC(O)CC1=CC=CC=C1

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PubChem CID	94185
CAS	698-87-3
Molecular Weight (g/mol)	136.19
MDL Number	MFCD00004540
SMILES	CC(O)CC1=CC=CC=C1
Synonym	Benzylmethylcarbinol
IUPAC Name	1-phenylpropan-2-ol
InChI Key	WYTRYIUQUDTGSX-UHFFFAOYNA-N
Molecular Formula	C9H12O

242

2-Bromo-4-(tert-butyl)aniline 98.0+%, TCI America™

CAS: 103273-01-4 Molecular Formula: C10H14BrN Molecular Weight (g/mol): 228.13 MDL Number: MFCD00052693 InChI Key: OLKYFBNIFKQRIZ-UHFFFAOYSA-N PubChem CID: 238591 IUPAC Name: 2-bromo-4-tert-butylaniline SMILES: CC(C)(C)C1=CC(Br)=C(N)C=C1

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Specifications

PubChem CID	238591
CAS	103273-01-4
Molecular Weight (g/mol)	228.13
MDL Number	MFCD00052693
SMILES	CC(C)(C)C1=CC(Br)=C(N)C=C1
IUPAC Name	2-bromo-4-tert-butylaniline
InChI Key	OLKYFBNIFKQRIZ-UHFFFAOYSA-N
Molecular Formula	C10H14BrN

243

3-Chlorophenylacetone 95.0+%, TCI America™

CAS: 14123-60-5 Molecular Formula: C9H9ClO Molecular Weight (g/mol): 168.62 MDL Number: MFCD00082872 InChI Key: VCNYPJMEQHTAHS-UHFFFAOYSA-N Synonym: 1-3-chlorophenyl propan-2-one,3-chlorophenylacetone,1-3-chlorophenyl acetone,1-3-chlorophenyl-2-propanone,pubchem19805,3-chlorophenyl-acetone,m-chlorophenyl acetone,2-propanone,1-3-chlorophenyl,1-3-chloro-phenyl-propan-2-one,2-propanone, 1-3-chlorophenyl 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
Synonym	1-3-chlorophenyl propan-2-one,3-chlorophenylacetone,1-3-chlorophenyl acetone,1-3-chlorophenyl-2-propanone,pubchem19805,3-chlorophenyl-acetone,m-chlorophenyl acetone,2-propanone,1-3-chlorophenyl,1-3-chloro-phenyl-propan-2-one,2-propanone, 1-3-chlorophenyl
IUPAC Name	1-(3-chlorophenyl)propan-2-one
InChI Key	VCNYPJMEQHTAHS-UHFFFAOYSA-N
Molecular Formula	C9H9ClO

244

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

CAS: 39895-55-1 Molecular Formula: C11H17N Molecular Weight (g/mol): 163.264 MDL Number: MFCD00040754 InChI Key: MPWSRGAWRAYBJK-UHFFFAOYSA-N Synonym: 4-tert-butylbenzylamine,4-tert-butylphenyl methanamine,4-t-butylbenzylamine,1-4-tert-butylphenyl methanamine,4-tert-butyl-benzylamine,4-tert-butyl phenyl methanamine,4-tert-butyl phenyl methylamine,4t-butylbenzylamine,p-t-butylbenzylamine,4-tertbutylbenzylamine PubChem CID: 2735655 IUPAC Name: (4-tert-butylphenyl)methanamine SMILES: CC(C)(C)C1=CC=C(C=C1)CN

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PubChem CID	2735655
CAS	39895-55-1
Molecular Weight (g/mol)	163.264
MDL Number	MFCD00040754
SMILES	CC(C)(C)C1=CC=C(C=C1)CN
Synonym	4-tert-butylbenzylamine,4-tert-butylphenyl methanamine,4-t-butylbenzylamine,1-4-tert-butylphenyl methanamine,4-tert-butyl-benzylamine,4-tert-butyl phenyl methanamine,4-tert-butyl phenyl methylamine,4t-butylbenzylamine,p-t-butylbenzylamine,4-tertbutylbenzylamine
IUPAC Name	(4-tert-butylphenyl)methanamine
InChI Key	MPWSRGAWRAYBJK-UHFFFAOYSA-N
Molecular Formula	C11H17N

245

(1S,2R)-2-(Dibutylamino)-1-phenyl-1-propanol 98.0+%, TCI America™

CAS: 114389-70-7 Molecular Formula: C17H29NO Molecular Weight (g/mol): 263.425 MDL Number: MFCD00142695 InChI Key: BRRGNOFUBFINSX-NVXWUHKLSA-N Synonym: (-)-alpha-[1-(Dibutylamino)ethyl]benzyl Alcohol, (-)-N,N-Dibutylnorephedrin PubChem CID: 11003877 IUPAC Name: (1S,2R)-2-(dibutylamino)-1-phenylpropan-1-ol SMILES: CCCCN(CCCC)C(C)C(C1=CC=CC=C1)O

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PubChem CID	11003877
CAS	114389-70-7
Molecular Weight (g/mol)	263.425
MDL Number	MFCD00142695
SMILES	CCCCN(CCCC)C(C)C(C1=CC=CC=C1)O
Synonym	(-)-alpha-[1-(Dibutylamino)ethyl]benzyl Alcohol, (-)-N,N-Dibutylnorephedrin
IUPAC Name	(1S,2R)-2-(dibutylamino)-1-phenylpropan-1-ol
InChI Key	BRRGNOFUBFINSX-NVXWUHKLSA-N
Molecular Formula	C17H29NO

246

4-(4-Propylphenyl)benzoic Acid 98.0+%, TCI America™

CAS: 88038-94-2 Molecular Formula: C16H16O2 Molecular Weight (g/mol): 240.302 MDL Number: MFCD00017335 InChI Key: HCPBURTZSXRGBN-UHFFFAOYSA-N Synonym: 4-4-propylphenyl benzoic acid,4-4-n-propylphenyl benzoic acid,4'-propyl-1,1'-biphenyl-4-carboxylic acid,4-propylbiphenyl-4'-carboxylic acid,4-propyl-4'-biphenylcarboxylic acid,4'-propylbiphenyl-4-carboxylic acid,4-n-propylbiphenyl-4'-carboxylic acid,4-p-n-propylphenyl benzoic acid,1,1'-biphenyl-4-carboxylic acid, 4'-propyl,4'-n-propylbiphenyl-4-carboxylic acid PubChem CID: 522891 IUPAC Name: 4-(4-propylphenyl)benzoic acid SMILES: CCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O

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PubChem CID	522891
CAS	88038-94-2
Molecular Weight (g/mol)	240.302
MDL Number	MFCD00017335
SMILES	CCCC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O
Synonym	4-4-propylphenyl benzoic acid,4-4-n-propylphenyl benzoic acid,4'-propyl-1,1'-biphenyl-4-carboxylic acid,4-propylbiphenyl-4'-carboxylic acid,4-propyl-4'-biphenylcarboxylic acid,4'-propylbiphenyl-4-carboxylic acid,4-n-propylbiphenyl-4'-carboxylic acid,4-p-n-propylphenyl benzoic acid,1,1'-biphenyl-4-carboxylic acid, 4'-propyl,4'-n-propylbiphenyl-4-carboxylic acid
IUPAC Name	4-(4-propylphenyl)benzoic acid
InChI Key	HCPBURTZSXRGBN-UHFFFAOYSA-N
Molecular Formula	C16H16O2

247

2,4,6-Tri-tert-butylnitrobenzene 95.0+%, TCI America™

CAS: 4074-25-3 Molecular Formula: C18H29NO2 Molecular Weight (g/mol): 291.435 MDL Number: MFCD00008818 InChI Key: IMDZOFHRUMJNQR-UHFFFAOYSA-N Synonym: 2,4,6-tri-tert-butylnitrobenzene,2,4,6-tri-t-butylnitrobenzene,1,3,5-tri-tert-butyl-2-nitrobenzene,1,3,5-tri tert-butyl-2-nitrobenzene,2,4,6 tri-tert-butylnitrobenzene,2-nitro-1,3,5-tri-tert-butylbenzene,acmc-209jgh,1,3,5-tritert-butyl-2-nitro-benzene,2-nitro-1,3,5-tritert-butyl-benzene,2,4,6-tri-tert-butyl-1-nitrobenzene PubChem CID: 77691 IUPAC Name: 1,3,5-tritert-butyl-2-nitrobenzene SMILES: CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)[N+](=O)[O-])C(C)(C)C

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PubChem CID	77691
CAS	4074-25-3
Molecular Weight (g/mol)	291.435
MDL Number	MFCD00008818
SMILES	CC(C)(C)C1=CC(=C(C(=C1)C(C)(C)C)[N+](=O)[O-])C(C)(C)C
Synonym	2,4,6-tri-tert-butylnitrobenzene,2,4,6-tri-t-butylnitrobenzene,1,3,5-tri-tert-butyl-2-nitrobenzene,1,3,5-tri tert-butyl-2-nitrobenzene,2,4,6 tri-tert-butylnitrobenzene,2-nitro-1,3,5-tri-tert-butylbenzene,acmc-209jgh,1,3,5-tritert-butyl-2-nitro-benzene,2-nitro-1,3,5-tritert-butyl-benzene,2,4,6-tri-tert-butyl-1-nitrobenzene
IUPAC Name	1,3,5-tritert-butyl-2-nitrobenzene
InChI Key	IMDZOFHRUMJNQR-UHFFFAOYSA-N
Molecular Formula	C18H29NO2

248

1,3,5-Tris(3,5-di-tert-butyl-4-hydroxybenzyl)-1,3,5-triazinane-2,4,6-trione 98.0+%, TCI America™

CAS: 27676-62-6 Molecular Formula: C48H69N3O6 Molecular Weight (g/mol): 784.10 MDL Number: MFCD00134700 InChI Key: VNQNXQYZMPJLQX-UHFFFAOYSA-N Synonym: Tris(3,5-di-tert-butyl-4-hydroxybenzyl) Isocyanurate, Isocyanuric Acid Tris(3,5-di-tert-butyl-4-hydroxybenzyl) Ester PubChem CID: 93115 IUPAC Name: tris[(3,5-di-tert-butyl-4-hydroxyphenyl)methyl]-1,3,5-triazinane-2,4,6-trione SMILES: CC(C)(C)C1=CC(CN2C(=O)N(CC3=CC(=C(O)C(=C3)C(C)(C)C)C(C)(C)C)C(=O)N(CC3=CC(=C(O)C(=C3)C(C)(C)C)C(C)(C)C)C2=O)=CC(=C1O)C(C)(C)C

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PubChem CID	93115
CAS	27676-62-6
Molecular Weight (g/mol)	784.10
MDL Number	MFCD00134700
SMILES	CC(C)(C)C1=CC(CN2C(=O)N(CC3=CC(=C(O)C(=C3)C(C)(C)C)C(C)(C)C)C(=O)N(CC3=CC(=C(O)C(=C3)C(C)(C)C)C(C)(C)C)C2=O)=CC(=C1O)C(C)(C)C
Synonym	Tris(3,5-di-tert-butyl-4-hydroxybenzyl) Isocyanurate, Isocyanuric Acid Tris(3,5-di-tert-butyl-4-hydroxybenzyl) Ester
IUPAC Name	tris[(3,5-di-tert-butyl-4-hydroxyphenyl)methyl]-1,3,5-triazinane-2,4,6-trione
InChI Key	VNQNXQYZMPJLQX-UHFFFAOYSA-N
Molecular Formula	C48H69N3O6

249

2-(4-Chlorophenyl)-3-methylbutyric Acid 98.0+%, TCI America™

CAS: 2012-74-0 Molecular Formula: C11H13ClO2 Molecular Weight (g/mol): 212.67 MDL Number: MFCD04112625,MFCD11858304,MFCD00037763 InChI Key: VTJMSIIXXKNIDJ-UHFFFAOYNA-N PubChem CID: 16197 ChEBI: CHEBI:39345 IUPAC Name: 2-(4-chlorophenyl)-3-methylbutanoic acid SMILES: CC(C)C(C(O)=O)C1=CC=C(Cl)C=C1

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PubChem CID	16197
CAS	2012-74-0
Molecular Weight (g/mol)	212.67
ChEBI	CHEBI:39345
MDL Number	MFCD04112625,MFCD11858304,MFCD00037763
SMILES	CC(C)C(C(O)=O)C1=CC=C(Cl)C=C1
IUPAC Name	2-(4-chlorophenyl)-3-methylbutanoic acid
InChI Key	VTJMSIIXXKNIDJ-UHFFFAOYNA-N
Molecular Formula	C11H13ClO2

250

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

251

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

252

Monoethyl 3,5-Di-tert-butyl-4-hydroxybenzylphosphonate 96.0+%, TCI America™

CAS: 66165-37-5 Molecular Formula: C17H29O4P Molecular Weight (g/mol): 328.39 MDL Number: MFCD06797098 InChI Key: WBSRIXCTCFFHEF-UHFFFAOYNA-N Synonym: 3,5-Di-tert-butyl-4-hydroxybenzylphosphonic Acid Monoethyl Ester, Ethyl Hydrogen 3,5-Di-tert-butyl-4-hydroxybenzylphosphonate PubChem CID: 92274 IUPAC Name: [(3,5-di-tert-butyl-4-hydroxyphenyl)methyl](ethoxy)phosphinic acid SMILES: CCOP(O)(=O)CC1=CC(=C(O)C(=C1)C(C)(C)C)C(C)(C)C

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PubChem CID	92274
CAS	66165-37-5
Molecular Weight (g/mol)	328.39
MDL Number	MFCD06797098
SMILES	CCOP(O)(=O)CC1=CC(=C(O)C(=C1)C(C)(C)C)C(C)(C)C
Synonym	3,5-Di-tert-butyl-4-hydroxybenzylphosphonic Acid Monoethyl Ester, Ethyl Hydrogen 3,5-Di-tert-butyl-4-hydroxybenzylphosphonate
IUPAC Name	[(3,5-di-tert-butyl-4-hydroxyphenyl)methyl](ethoxy)phosphinic acid
InChI Key	WBSRIXCTCFFHEF-UHFFFAOYNA-N
Molecular Formula	C17H29O4P

253

1,4-Di-tert-butylbenzene 99.0+%, TCI America™

CAS: 1012-72-2 Molecular Formula: C14H22 Molecular Weight (g/mol): 190.33 MDL Number: MFCD00008836 InChI Key: OOWNNCMFKFBNOF-UHFFFAOYSA-N Synonym: 1,4-di-tert-butylbenzene,p-di-tert-butylbenzene,benzene, p-di-tert-butyl,benzene, 1,4-bis 1,1-dimethylethyl,unii-55ptx4kh71,bis 1,1-dimethylethyl benzene,benzene, bis 1,1-dimethylethyl,1,4-di-t-butylbenzene,acmc-2097up,1,4-bis tert-butyl benzene PubChem CID: 13895 IUPAC Name: 1,4-ditert-butylbenzene SMILES: CC(C)(C)C1=CC=C(C=C1)C(C)(C)C

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PubChem CID	13895
CAS	1012-72-2
Molecular Weight (g/mol)	190.33
MDL Number	MFCD00008836
SMILES	CC(C)(C)C1=CC=C(C=C1)C(C)(C)C
Synonym	1,4-di-tert-butylbenzene,p-di-tert-butylbenzene,benzene, p-di-tert-butyl,benzene, 1,4-bis 1,1-dimethylethyl,unii-55ptx4kh71,bis 1,1-dimethylethyl benzene,benzene, bis 1,1-dimethylethyl,1,4-di-t-butylbenzene,acmc-2097up,1,4-bis tert-butyl benzene
IUPAC Name	1,4-ditert-butylbenzene
InChI Key	OOWNNCMFKFBNOF-UHFFFAOYSA-N
Molecular Formula	C14H22

254

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

255

(R)-(+)-1-Phenyl-1-propanol 98.0+%, TCI America™

CAS: 1565-74-8 Molecular Formula: C9H12O Molecular Weight (g/mol): 136.194 MDL Number: MFCD00064279 InChI Key: DYUQAZSOFZSPHD-SECBINFHSA-N Synonym: r-+-1-phenyl-1-propanol,r-1-phenylpropan-1-ol,1r-1-phenylpropan-1-ol,r-1-phenyl-1-propanol,r-1-phenyl-propanol,r-+-alpha-ethylbenzyl alcohol,r-+-1-phenylpropanol,r-1-phenylpropanol,1-phenyl-1-propanol #,r-1-phenyl-1propanol PubChem CID: 640199 IUPAC Name: (1R)-1-phenylpropan-1-ol SMILES: CCC(C1=CC=CC=C1)O

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PubChem CID	640199
CAS	1565-74-8
Molecular Weight (g/mol)	136.194
MDL Number	MFCD00064279
SMILES	CCC(C1=CC=CC=C1)O
Synonym	r-+-1-phenyl-1-propanol,r-1-phenylpropan-1-ol,1r-1-phenylpropan-1-ol,r-1-phenyl-1-propanol,r-1-phenyl-propanol,r-+-alpha-ethylbenzyl alcohol,r-+-1-phenylpropanol,r-1-phenylpropanol,1-phenyl-1-propanol #,r-1-phenyl-1propanol
IUPAC Name	(1R)-1-phenylpropan-1-ol
InChI Key	DYUQAZSOFZSPHD-SECBINFHSA-N
Molecular Formula	C9H12O

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