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 – 15 of 349 results

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Bisphenol A, 97+%

CAS: 80-05-7 Molecular Formula: C15H16O2 Molecular Weight (g/mol): 228.29 MDL Number: MFCD00002366 InChI Key: IISBACLAFKSPIT-UHFFFAOYSA-N Synonym: bisphenol a,2,2-bis 4-hydroxyphenyl propane,4,4'-isopropylidenediphenol,diphenylolpropane,bisphenol,diano,4,4'-bisphenol a,4,4'-propane-2,2-diyl diphenol,biphenol a,dian PubChem CID: 6623 ChEBI: CHEBI:33216 IUPAC Name: 4-[2-(4-hydroxyphenyl)propan-2-yl]phenol SMILES: CC(C)(C1=CC=C(O)C=C1)C1=CC=C(O)C=C1

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PubChem CID	6623
CAS	80-05-7
Molecular Weight (g/mol)	228.29
ChEBI	CHEBI:33216
MDL Number	MFCD00002366
SMILES	CC(C)(C1=CC=C(O)C=C1)C1=CC=C(O)C=C1
Synonym	bisphenol a,2,2-bis 4-hydroxyphenyl propane,4,4'-isopropylidenediphenol,diphenylolpropane,bisphenol,diano,4,4'-bisphenol a,4,4'-propane-2,2-diyl diphenol,biphenol a,dian
IUPAC Name	4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
InChI Key	IISBACLAFKSPIT-UHFFFAOYSA-N
Molecular Formula	C15H16O2

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2-tert-Butyl-4-methylphenol, 99%

CAS: 2409-55-4 Molecular Formula: C₁₁H₁₆O Molecular Weight (g/mol): 164.25 MDL Number: MFCD00002381 InChI Key: IKEHOXWJQXIQAG-UHFFFAOYSA-N Synonym: 2-tert-butyl-4-methylphenol,2-tert-butyl-p-cresol,2-t-butyl-p-cresol,p-cresol, 2-tert-butyl,o-tert-butyl-p-cresol,2-t-butyl-4-methylphenol,4-methyl-2-tert-butylphenol,2-terc.butyl-p-kresol,phenol, 2-1,1-dimethylethyl-4-methyl,4-methyl-6-t-butylphenol PubChem CID: 17004 IUPAC Name: 2-tert-butyl-4-methylphenol SMILES: CC1=CC(=C(C=C1)O)C(C)(C)C

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PubChem CID	17004
CAS	2409-55-4
Molecular Weight (g/mol)	164.25
MDL Number	MFCD00002381
SMILES	CC1=CC(=C(C=C1)O)C(C)(C)C
Synonym	2-tert-butyl-4-methylphenol,2-tert-butyl-p-cresol,2-t-butyl-p-cresol,p-cresol, 2-tert-butyl,o-tert-butyl-p-cresol,2-t-butyl-4-methylphenol,4-methyl-2-tert-butylphenol,2-terc.butyl-p-kresol,phenol, 2-1,1-dimethylethyl-4-methyl,4-methyl-6-t-butylphenol
IUPAC Name	2-tert-butyl-4-methylphenol
InChI Key	IKEHOXWJQXIQAG-UHFFFAOYSA-N
Molecular Formula	C₁₁H₁₆O

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4-tert-Butylbenzoic acid, 99%

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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Specifications

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

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(R)-(-)-2-Phenylbutyric acid, 99%

CAS: 938-79-4 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.20 MDL Number: MFCD00063165 InChI Key: OFJWFSNDPCAWDK-UHFFFAOYNA-N Synonym: r---2-phenylbutyric acid,2r-2-phenylbutanoic acid,2-phenylbutyric acid, r,r-2-phenylbutyric acid,benzeneacetic acid, alpha-ethyl-, r,r-2-phenylbutanoic acid,2r-2-phenyl-butanoic acid,2r-2-phenyl-mutanoic acid,r---2-phenylbutanoic acid,benzeneacetic acid,a-ethyl-, ar PubChem CID: 785330 IUPAC Name: (2R)-2-phenylbutanoic acid SMILES: CCC(C(O)=O)C1=CC=CC=C1

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PubChem CID	785330
CAS	938-79-4
Molecular Weight (g/mol)	164.20
MDL Number	MFCD00063165
SMILES	CCC(C(O)=O)C1=CC=CC=C1
Synonym	r---2-phenylbutyric acid,2r-2-phenylbutanoic acid,2-phenylbutyric acid, r,r-2-phenylbutyric acid,benzeneacetic acid, alpha-ethyl-, r,r-2-phenylbutanoic acid,2r-2-phenyl-butanoic acid,2r-2-phenyl-mutanoic acid,r---2-phenylbutanoic acid,benzeneacetic acid,a-ethyl-, ar
IUPAC Name	(2R)-2-phenylbutanoic acid
InChI Key	OFJWFSNDPCAWDK-UHFFFAOYNA-N
Molecular Formula	C10H12O2

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4-n-Propylphenol, 98%

CAS: 645-56-7 Molecular Formula: C9H12O Molecular Weight (g/mol): 136.194 MDL Number: MFCD00002395 InChI Key: KLSLBUSXWBJMEC-UHFFFAOYSA-N Synonym: 4-n-propylphenol,p-propylphenol,phenol, 4-propyl,dihydrochavicol,phenol, p-propyl,1-hydroxy-4-n-propylbenzene,p-n-propylphenol,4-propyl-phenol,p-hydroxypropylbenzene,hydroxypropylbenzene, p PubChem CID: 12580 ChEBI: CHEBI:34434 IUPAC Name: 4-propylphenol SMILES: CCCC1=CC=C(C=C1)O

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PubChem CID	12580
CAS	645-56-7
Molecular Weight (g/mol)	136.194
ChEBI	CHEBI:34434
MDL Number	MFCD00002395
SMILES	CCCC1=CC=C(C=C1)O
Synonym	4-n-propylphenol,p-propylphenol,phenol, 4-propyl,dihydrochavicol,phenol, p-propyl,1-hydroxy-4-n-propylbenzene,p-n-propylphenol,4-propyl-phenol,p-hydroxypropylbenzene,hydroxypropylbenzene, p
IUPAC Name	4-propylphenol
InChI Key	KLSLBUSXWBJMEC-UHFFFAOYSA-N
Molecular Formula	C9H12O

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2-Phenyl-2-propanol, 98+%

CAS: 617-94-7 Molecular Formula: C9H12O Molecular Weight (g/mol): 136.19 MDL Number: MFCD00004456 InChI Key: BDCFWIDZNLCTMF-UHFFFAOYSA-N Synonym: 2-phenyl-2-propanol,dimethylphenylcarbinol,1-hydroxycumene,dimethylphenylmethanol,alpha-cumyl alcohol,phenyldimethylcarbinol,2-propanol, 2-phenyl,2-phenylisopropanol,alpha,alpha-dimethylbenzyl alcohol,2-phenyl-propan-2-ol PubChem CID: 12053 IUPAC Name: 2-phenylpropan-2-ol SMILES: CC(C)(O)C1=CC=CC=C1

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Specifications

PubChem CID	12053
CAS	617-94-7
Molecular Weight (g/mol)	136.19
MDL Number	MFCD00004456
SMILES	CC(C)(O)C1=CC=CC=C1
Synonym	2-phenyl-2-propanol,dimethylphenylcarbinol,1-hydroxycumene,dimethylphenylmethanol,alpha-cumyl alcohol,phenyldimethylcarbinol,2-propanol, 2-phenyl,2-phenylisopropanol,alpha,alpha-dimethylbenzyl alcohol,2-phenyl-propan-2-ol
IUPAC Name	2-phenylpropan-2-ol
InChI Key	BDCFWIDZNLCTMF-UHFFFAOYSA-N
Molecular Formula	C9H12O

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4-tert-Butylphenoxyacetyl chloride, 98%

CAS: 90734-55-7 Molecular Formula: C12H15ClO2 Molecular Weight (g/mol): 226.70 MDL Number: MFCD00798568 InChI Key: CFTNMBDQWVPSHI-UHFFFAOYSA-N Synonym: 4-tert-butylphenoxyacetyl chloride,4-tert-butylphenoxy acetyl chloride,2-4-tert-butylphenoxy acetyl chloride,2-4-tert-butyl phenoxy acetyl chloride,pubchem14851,4-tert-butylphenoxyacetyl cloride,para-t-butylphenoxyacetyl chloride,4-t-butyl-phenoxy acetyl chloride,4-tert-butyl-phenoxyacetyl chloride PubChem CID: 611195 IUPAC Name: 2-(4-tert-butylphenoxy)acetyl chloride SMILES: CC(C)(C)C1=CC=C(OCC(Cl)=O)C=C1

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Specifications

PubChem CID	611195
CAS	90734-55-7
Molecular Weight (g/mol)	226.70
MDL Number	MFCD00798568
SMILES	CC(C)(C)C1=CC=C(OCC(Cl)=O)C=C1
Synonym	4-tert-butylphenoxyacetyl chloride,4-tert-butylphenoxy acetyl chloride,2-4-tert-butylphenoxy acetyl chloride,2-4-tert-butyl phenoxy acetyl chloride,pubchem14851,4-tert-butylphenoxyacetyl cloride,para-t-butylphenoxyacetyl chloride,4-t-butyl-phenoxy acetyl chloride,4-tert-butyl-phenoxyacetyl chloride
IUPAC Name	2-(4-tert-butylphenoxy)acetyl chloride
InChI Key	CFTNMBDQWVPSHI-UHFFFAOYSA-N
Molecular Formula	C12H15ClO2

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4-tert-Butylbenzonitrile, 98+%

CAS: 4210-32-6 Molecular Formula: C11H13N Molecular Weight (g/mol): 159.232 MDL Number: MFCD00075840 InChI Key: IIZURLNRIMKEDL-UHFFFAOYSA-N Synonym: 4-tert-butyl benzonitrile,4-t-butylbenzonitrile,benzonitrile, 4-1,1-dimethylethyl,4-tert-butylcyanobenzene,4-tert-butyl-benzonitrile,p-t-butylbenzonitrile,acmc-209jnk,p-tert-butylbenzonitrile,benzonitrile, p-tert-butyl,ksc219k6d PubChem CID: 77883 IUPAC Name: 4-tert-butylbenzonitrile SMILES: CC(C)(C)C1=CC=C(C=C1)C#N

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PubChem CID	77883
CAS	4210-32-6
Molecular Weight (g/mol)	159.232
MDL Number	MFCD00075840
SMILES	CC(C)(C)C1=CC=C(C=C1)C#N
Synonym	4-tert-butyl benzonitrile,4-t-butylbenzonitrile,benzonitrile, 4-1,1-dimethylethyl,4-tert-butylcyanobenzene,4-tert-butyl-benzonitrile,p-t-butylbenzonitrile,acmc-209jnk,p-tert-butylbenzonitrile,benzonitrile, p-tert-butyl,ksc219k6d
IUPAC Name	4-tert-butylbenzonitrile
InChI Key	IIZURLNRIMKEDL-UHFFFAOYSA-N
Molecular Formula	C11H13N

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3,5-Di-tert-butyltoluene, 98+%, Thermo Scientific Chemicals

CAS: 15181-11-0 Molecular Formula: C15H24 Molecular Weight (g/mol): 204.357 MDL Number: MFCD00026300 InChI Key: WIXDSJRJFDWTNY-UHFFFAOYSA-N Synonym: 3,5-di-tert-butyltoluene,1,3-di-tert-butyl-5-methylbenzene,toluene, 3,5-di-tert-butyl,3,5-bis tert-butyl toluene,benzene, 1,3-bis 1,1-dimethylethyl-5-methyl,3,5-di-t-butyltoluene,3,5-bis t-butyl-1-methylbenzene,3,5-di-tert-butyl-1-methylbenzene,1,3-bis tert-butyl-5-methylbenzene PubChem CID: 84819 IUPAC Name: 1,3-ditert-butyl-5-methylbenzene SMILES: CC1=CC(=CC(=C1)C(C)(C)C)C(C)(C)C

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PubChem CID	84819
CAS	15181-11-0
Molecular Weight (g/mol)	204.357
MDL Number	MFCD00026300
SMILES	CC1=CC(=CC(=C1)C(C)(C)C)C(C)(C)C
Synonym	3,5-di-tert-butyltoluene,1,3-di-tert-butyl-5-methylbenzene,toluene, 3,5-di-tert-butyl,3,5-bis tert-butyl toluene,benzene, 1,3-bis 1,1-dimethylethyl-5-methyl,3,5-di-t-butyltoluene,3,5-bis t-butyl-1-methylbenzene,3,5-di-tert-butyl-1-methylbenzene,1,3-bis tert-butyl-5-methylbenzene
IUPAC Name	1,3-ditert-butyl-5-methylbenzene
InChI Key	WIXDSJRJFDWTNY-UHFFFAOYSA-N
Molecular Formula	C15H24

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4-tert-Butylstyrene, 94%, stab. with 50 ppm 4-tert-butylcatechol

CAS: 1746-23-2 Molecular Formula: C12H16 Molecular Weight (g/mol): 160.26 MDL Number: MFCD00065126 InChI Key: QEDJMOONZLUIMC-UHFFFAOYSA-N Synonym: 4-tert-butylstyrene,p-tert-butylstyrene,p-t-butylstyrene,benzene, 1-1,1-dimethylethyl-4-ethenyl,styrene, p-tert-butyl,unii-9pct9cbw0v,1-1,1-dimethylethyl-4-ethenylbenzene,9pct9cbw0v,1-tert-butyl-4-vinylbenzene,4-t-butyl styrene PubChem CID: 15627 IUPAC Name: 1-tert-butyl-4-ethenylbenzene SMILES: CC(C)(C)C1=CC=C(C=C1)C=C

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PubChem CID	15627
CAS	1746-23-2
Molecular Weight (g/mol)	160.26
MDL Number	MFCD00065126
SMILES	CC(C)(C)C1=CC=C(C=C1)C=C
Synonym	4-tert-butylstyrene,p-tert-butylstyrene,p-t-butylstyrene,benzene, 1-1,1-dimethylethyl-4-ethenyl,styrene, p-tert-butyl,unii-9pct9cbw0v,1-1,1-dimethylethyl-4-ethenylbenzene,9pct9cbw0v,1-tert-butyl-4-vinylbenzene,4-t-butyl styrene
IUPAC Name	1-tert-butyl-4-ethenylbenzene
InChI Key	QEDJMOONZLUIMC-UHFFFAOYSA-N
Molecular Formula	C12H16

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2,6-Di-tert-butyl-4-methylphenol, 99%

CAS: 128-37-0 Molecular Formula: C₁₅H₂₄O Molecular Weight (g/mol): 220.35 MDL Number: MFCD00011644 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)	220.35
ChEBI	CHEBI:34247
MDL Number	MFCD00011644
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

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2-Amino-4-tert-butylphenol, 97%

CAS: 1199-46-8 Molecular Formula: C10H15NO Molecular Weight (g/mol): 165.24 MDL Number: MFCD00007698 InChI Key: RPJUVNYXHUCRMG-UHFFFAOYSA-N Synonym: 2-amino-4-tert-butyl phenol,2-amino-4-tert-butyl-phenol,2-amino-4-t-butylphenol,unii-28021lmq3d,phenol, 2-amino-4-1,1-dimethylethyl,p-tert-butyl-o-aminophenol,acmc-209a4q,4-tert-butyl-2-aminophenol,bidd:gt0022,2-azanyl-4-tert-butyl-phenol PubChem CID: 70982 IUPAC Name: 2-amino-4-tert-butylphenol SMILES: CC(C)(C)C1=CC=C(O)C(N)=C1

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Specifications

PubChem CID	70982
CAS	1199-46-8
Molecular Weight (g/mol)	165.24
MDL Number	MFCD00007698
SMILES	CC(C)(C)C1=CC=C(O)C(N)=C1
Synonym	2-amino-4-tert-butyl phenol,2-amino-4-tert-butyl-phenol,2-amino-4-t-butylphenol,unii-28021lmq3d,phenol, 2-amino-4-1,1-dimethylethyl,p-tert-butyl-o-aminophenol,acmc-209a4q,4-tert-butyl-2-aminophenol,bidd:gt0022,2-azanyl-4-tert-butyl-phenol
IUPAC Name	2-amino-4-tert-butylphenol
InChI Key	RPJUVNYXHUCRMG-UHFFFAOYSA-N
Molecular Formula	C10H15NO

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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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Specifications

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

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4-tert-Pentylphenol, 99%

CAS: 80-46-6 Molecular Formula: C11H16O Molecular Weight (g/mol): 164.248 MDL Number: MFCD00002369 InChI Key: NRZWYNLTFLDQQX-UHFFFAOYSA-N Synonym: 4-tert-amylphenol,4-tert-pentylphenol,p-tert-amylphenol,p-tert-pentylphenol,4-t-amylphenol,4-1,1-dimethylpropyl phenol,amilphenol,amilfenol,pentaphen,tert-amylphenol PubChem CID: 6643 ChEBI: CHEBI:35096 IUPAC Name: 4-(2-methylbutan-2-yl)phenol SMILES: CCC(C)(C)C1=CC=C(C=C1)O

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Specifications

PubChem CID	6643
CAS	80-46-6
Molecular Weight (g/mol)	164.248
ChEBI	CHEBI:35096
MDL Number	MFCD00002369
SMILES	CCC(C)(C)C1=CC=C(C=C1)O
Synonym	4-tert-amylphenol,4-tert-pentylphenol,p-tert-amylphenol,p-tert-pentylphenol,4-t-amylphenol,4-1,1-dimethylpropyl phenol,amilphenol,amilfenol,pentaphen,tert-amylphenol
IUPAC Name	4-(2-methylbutan-2-yl)phenol
InChI Key	NRZWYNLTFLDQQX-UHFFFAOYSA-N
Molecular Formula	C11H16O

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tert-Butylhydroquinone, 97%

CAS: 1948-33-0 Molecular Formula: C₁₀H₁₄O₂ Molecular Weight (g/mol): 166.22 MDL Number: MFCD00002344 InChI Key: BGNXCDMCOKJUMV-UHFFFAOYSA-N Synonym: tert-butylhydroquinone,tbhq,2-tert-butylhydroquinone,t-butylhydroquinone,mtbhq,t-butyl hydroquinone,2-tert-butyl-1,4-benzenediol,2-t-butylhydroquinone,mono-tert-butylhydroquinone,sustane PubChem CID: 16043 ChEBI: CHEBI:78886 IUPAC Name: 2-tert-butylbenzene-1,4-diol SMILES: CC(C)(C)C1=C(C=CC(=C1)O)O

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Specifications

PubChem CID	16043
CAS	1948-33-0
Molecular Weight (g/mol)	166.22
ChEBI	CHEBI:78886
MDL Number	MFCD00002344
SMILES	CC(C)(C)C1=C(C=CC(=C1)O)O
Synonym	tert-butylhydroquinone,tbhq,2-tert-butylhydroquinone,t-butylhydroquinone,mtbhq,t-butyl hydroquinone,2-tert-butyl-1,4-benzenediol,2-t-butylhydroquinone,mono-tert-butylhydroquinone,sustane
IUPAC Name	2-tert-butylbenzene-1,4-diol
InChI Key	BGNXCDMCOKJUMV-UHFFFAOYSA-N
Molecular Formula	C₁₀H₁₄O₂

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