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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
1

BisphenolA, ≥99%, MilliporeSigma™ Supelco™

MDL Number: MFCD00002366 Synonym: 2,2-Bis(4-hydroxyphenyl)propane; 4,4 ′-Isopropylidenediphenol

MDL Number MFCD00002366
Synonym 2,2-Bis(4-hydroxyphenyl)propane; 4,4 ′-Isopropylidenediphenol
2

3,5-Di(tert-butyl)-4-hydroxybenzonitrile, 97%, Thermo Scientific™

CAS: 1988-88-1 Molecular Formula: C15H21NO Molecular Weight (g/mol): 231.34 MDL Number: MFCD00156137 InChI Key: AKXIIOLURNATOC-UHFFFAOYSA-N Synonym: 3,5-di-tert-butyl-4-hydroxybenzonitrile,3,5-di tert-butyl-4-hydroxybenzonitrile,benzonitrile, 3,5-bis 1,1-dimethylethyl-4-hydroxy,benzonitrile, 3,5-di-tert-butyl-4-hydroxy,4-cyano-2,6-di-tert-butylphenol,3,5-bis tert-butyl-4-hydroxybenzenecarbonitrile,acmc-20a6ry,2,6-bis tert-butyl-4-cyanophenol,3,5-di-t-butyl-4-hydroxybenzonitrile,4-hydroxy-3,5-di-t-butylbenzonitrile PubChem CID: 137274 SMILES: CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C#N

PubChem CID 137274
CAS 1988-88-1
Molecular Weight (g/mol) 231.34
MDL Number MFCD00156137
SMILES CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C#N
Synonym 3,5-di-tert-butyl-4-hydroxybenzonitrile,3,5-di tert-butyl-4-hydroxybenzonitrile,benzonitrile, 3,5-bis 1,1-dimethylethyl-4-hydroxy,benzonitrile, 3,5-di-tert-butyl-4-hydroxy,4-cyano-2,6-di-tert-butylphenol,3,5-bis tert-butyl-4-hydroxybenzenecarbonitrile,acmc-20a6ry,2,6-bis tert-butyl-4-cyanophenol,3,5-di-t-butyl-4-hydroxybenzonitrile,4-hydroxy-3,5-di-t-butylbenzonitrile
InChI Key AKXIIOLURNATOC-UHFFFAOYSA-N
Molecular Formula C15H21NO
3

TraceCERT™ Lilial, 2000 μg/mL, Certified Reference Material, MilliporeSigma™ Supelco™

This certified reference material (CRM) is produced and certified in accordance with ISO/IEC 17025 and ISO 17034. This CRM is traceable to the SI through a primary reference material from a NMI. Certified content incl. uncertainty and expiry date are stated on the enclosed certificate.

4

Methyl 4-tert-butylbenzoate, 98+%

CAS: 26537-19-9 Molecular Formula: C12H16O2 Molecular Weight (g/mol): 192.258 MDL Number: MFCD00008835 InChI Key: UPIJOAFHOIWPLT-UHFFFAOYSA-N Synonym: methyl 4-tert-butyl benzoate,methyl p-tert-butylbenzoate,4-tert-butylbenzoic acid methyl ester,unii-8vk4o27jmt,benzoic acid, 4-1,1-dimethylethyl-, methyl ester,methyl 4-t-butylbenzoate,8vk4o27jmt,methyl4-tert-butylbenzoate,methyl p-t-butylbenzoate,benzoic acid, p-tert-butyl-, methyl ester PubChem CID: 97433 IUPAC Name: methyl 4-tert-butylbenzoate SMILES: CC(C)(C)C1=CC=C(C=C1)C(=O)OC

PubChem CID 97433
CAS 26537-19-9
Molecular Weight (g/mol) 192.258
MDL Number MFCD00008835
SMILES CC(C)(C)C1=CC=C(C=C1)C(=O)OC
Synonym methyl 4-tert-butyl benzoate,methyl p-tert-butylbenzoate,4-tert-butylbenzoic acid methyl ester,unii-8vk4o27jmt,benzoic acid, 4-1,1-dimethylethyl-, methyl ester,methyl 4-t-butylbenzoate,8vk4o27jmt,methyl4-tert-butylbenzoate,methyl p-t-butylbenzoate,benzoic acid, p-tert-butyl-, methyl ester
IUPAC Name methyl 4-tert-butylbenzoate
InChI Key UPIJOAFHOIWPLT-UHFFFAOYSA-N
Molecular Formula C12H16O2
5

4-Nitrophenylacetone, 98%

CAS: 5332-96-7 Molecular Formula: C9H9NO3 Molecular Weight (g/mol): 179.175 MDL Number: MFCD00051518 InChI Key: GEWWCWZGHNIUBW-UHFFFAOYSA-N Synonym: 4-nitrophenylacetone,1-4-nitrophenyl propan-2-one,2-propanone, 1-4-nitrophenyl,1-4-nitrophenyl-2-propanone,1-4-nitrophenyl acetone,p-nitrophenylazeton,p-nitrophenylacetone,pubchem18646,4-nitrophenyl acetone,acmc-1az6k PubChem CID: 219367 IUPAC Name: 1-(4-nitrophenyl)propan-2-one SMILES: CC(=O)CC1=CC=C(C=C1)[N+](=O)[O-]

PubChem CID 219367
CAS 5332-96-7
Molecular Weight (g/mol) 179.175
MDL Number MFCD00051518
SMILES CC(=O)CC1=CC=C(C=C1)[N+](=O)[O-]
Synonym 4-nitrophenylacetone,1-4-nitrophenyl propan-2-one,2-propanone, 1-4-nitrophenyl,1-4-nitrophenyl-2-propanone,1-4-nitrophenyl acetone,p-nitrophenylazeton,p-nitrophenylacetone,pubchem18646,4-nitrophenyl acetone,acmc-1az6k
IUPAC Name 1-(4-nitrophenyl)propan-2-one
InChI Key GEWWCWZGHNIUBW-UHFFFAOYSA-N
Molecular Formula C9H9NO3
6

4-tert-Butylbenzeneboronic acid, 97%

CAS: 123324-71-0 Molecular Formula: C10H15BO2 Molecular Weight (g/mol): 178.04 MDL Number: MFCD01009697 InChI Key: MNJYZNVROSZZQC-UHFFFAOYSA-N Synonym: 4-t-butylphenylboronic acid,4-tert-butylbenzeneboronic acid,4-tert-butyl phenyl boronic acid,4-tert-butylphenyl boronic acid,4-tert-butyl phenylboronic acid,4-tert-butyl-phenyl boronic acid,4-tert-butylphenyl boranediol,p-t-butylphenylboronic acid,4-tertbutylphenylboronic acid PubChem CID: 2734320 IUPAC Name: (4-tert-butylphenyl)boronic acid SMILES: CC(C)(C)C1=CC=C(C=C1)B(O)O

PubChem CID 2734320
CAS 123324-71-0
Molecular Weight (g/mol) 178.04
MDL Number MFCD01009697
SMILES CC(C)(C)C1=CC=C(C=C1)B(O)O
Synonym 4-t-butylphenylboronic acid,4-tert-butylbenzeneboronic acid,4-tert-butyl phenyl boronic acid,4-tert-butylphenyl boronic acid,4-tert-butyl phenylboronic acid,4-tert-butyl-phenyl boronic acid,4-tert-butylphenyl boranediol,p-t-butylphenylboronic acid,4-tertbutylphenylboronic acid
IUPAC Name (4-tert-butylphenyl)boronic acid
InChI Key MNJYZNVROSZZQC-UHFFFAOYSA-N
Molecular Formula C10H15BO2
7

2-(4-tert-Butylphenyl)ethanol, 96%

CAS: 5406-86-0 Molecular Formula: C12H18O Molecular Weight (g/mol): 178.275 MDL Number: MFCD00236023 InChI Key: NZGMMENPUKHODD-UHFFFAOYSA-N Synonym: 2-4-tert-butylphenyl ethanol,2-4-tert-butyl phenyl ethanol,p-tert-butylphenethyl alcohol,p-tert-butyl phenethyl alcohol,phenethyl alcohol, p-tert-butyl,4-tert-butylphenethyl alcohol,unii-aes74i7nru,aes74i7nru,benzeneethanol, 4-1,1-dimethylethyl PubChem CID: 79410 IUPAC Name: 2-(4-tert-butylphenyl)ethanol SMILES: CC(C)(C)C1=CC=C(C=C1)CCO

PubChem CID 79410
CAS 5406-86-0
Molecular Weight (g/mol) 178.275
MDL Number MFCD00236023
SMILES CC(C)(C)C1=CC=C(C=C1)CCO
Synonym 2-4-tert-butylphenyl ethanol,2-4-tert-butyl phenyl ethanol,p-tert-butylphenethyl alcohol,p-tert-butyl phenethyl alcohol,phenethyl alcohol, p-tert-butyl,4-tert-butylphenethyl alcohol,unii-aes74i7nru,aes74i7nru,benzeneethanol, 4-1,1-dimethylethyl
IUPAC Name 2-(4-tert-butylphenyl)ethanol
InChI Key NZGMMENPUKHODD-UHFFFAOYSA-N
Molecular Formula C12H18O
8

Amorolfine hydrochloride, 98%

CAS: 78613-38-4 Molecular Formula: C21H35NO·HCl Molecular Weight (g/mol): 353.97 InChI Key: XZKWIPVTHGWDCF-KUZYQSSXSA-N Synonym: amorolfine hydrochloride,amorolfine hcl,loceryl,curanail,locetar,odenil,amorolfin,pekiron,amorolfine hydrochloride jan PubChem CID: 54259 ChEBI: CHEBI:59649 IUPAC Name: (2R,6S)-2,6-dimethyl-4-[2-methyl-3-[4-(2-methylbutan-2-yl)phenyl]propyl]morpholine;hydrochloride SMILES: CCC(C)(C)C1=CC=C(C=C1)CC(C)CN2CC(OC(C2)C)C.Cl

PubChem CID 54259
CAS 78613-38-4
Molecular Weight (g/mol) 353.97
ChEBI CHEBI:59649
SMILES CCC(C)(C)C1=CC=C(C=C1)CC(C)CN2CC(OC(C2)C)C.Cl
Synonym amorolfine hydrochloride,amorolfine hcl,loceryl,curanail,locetar,odenil,amorolfin,pekiron,amorolfine hydrochloride jan
IUPAC Name (2R,6S)-2,6-dimethyl-4-[2-methyl-3-[4-(2-methylbutan-2-yl)phenyl]propyl]morpholine;hydrochloride
InChI Key XZKWIPVTHGWDCF-KUZYQSSXSA-N
Molecular Formula C21H35NO·HCl
9

1,3-Di-tert-butylbenzene, 99%

CAS: 1014-60-4 Molecular Formula: C14H22 Molecular Weight (g/mol): 190.33 MDL Number: MFCD00008830 InChI Key: ILNDSSCEZZFNGE-UHFFFAOYSA-N Synonym: 1,3-di-tert-butylbenzene,benzene, 1,3-bis 1,1-dimethylethyl,benzene, m-di-tert-butyl,m-di-tert-butylbenzene,1,3-di-t-butylbenzene,1,3-ditert-butyl-benzene,1,3-ditertiarybutylbenzene,1,3-di-tert-butyl-benzene,acmc-1bo58,1,3-bis tert-butyl benzene PubChem CID: 136810 IUPAC Name: 1,3-ditert-butylbenzene SMILES: CC(C)(C)C1=CC(=CC=C1)C(C)(C)C

PubChem CID 136810
CAS 1014-60-4
Molecular Weight (g/mol) 190.33
MDL Number MFCD00008830
SMILES CC(C)(C)C1=CC(=CC=C1)C(C)(C)C
Synonym 1,3-di-tert-butylbenzene,benzene, 1,3-bis 1,1-dimethylethyl,benzene, m-di-tert-butyl,m-di-tert-butylbenzene,1,3-di-t-butylbenzene,1,3-ditert-butyl-benzene,1,3-ditertiarybutylbenzene,1,3-di-tert-butyl-benzene,acmc-1bo58,1,3-bis tert-butyl benzene
IUPAC Name 1,3-ditert-butylbenzene
InChI Key ILNDSSCEZZFNGE-UHFFFAOYSA-N
Molecular Formula C14H22
10

4,4'-Di-tert-butylbiphenyl, 99%

CAS: 1625-91-8 Molecular Formula: C20H26 Molecular Weight (g/mol): 266.428 MDL Number: MFCD00008834 InChI Key: CDKCEZNPAYWORX-UHFFFAOYSA-N Synonym: 4,4'-di-tert-butylbiphenyl,4,4'-di-tert-butyl-1,1'-biphenyl,4,4'-di-t-butylbiphenyl,1-tert-butyl-4-4-tert-butylphenyl benzene,1,1'-biphenyl, 4,4'-bis 1,1-dimethylethyl,1-tert-butyl-4-4-tert-butyl phenyl benzene,di-t-butylbiphenyl,pubchem9048,acmc-209st2,4,4'-di-tertbutylbiphenyl PubChem CID: 74195 IUPAC Name: 1-tert-butyl-4-(4-tert-butylphenyl)benzene SMILES: CC(C)(C)C1=CC=C(C=C1)C2=CC=C(C=C2)C(C)(C)C

PubChem CID 74195
CAS 1625-91-8
Molecular Weight (g/mol) 266.428
MDL Number MFCD00008834
SMILES CC(C)(C)C1=CC=C(C=C1)C2=CC=C(C=C2)C(C)(C)C
Synonym 4,4'-di-tert-butylbiphenyl,4,4'-di-tert-butyl-1,1'-biphenyl,4,4'-di-t-butylbiphenyl,1-tert-butyl-4-4-tert-butylphenyl benzene,1,1'-biphenyl, 4,4'-bis 1,1-dimethylethyl,1-tert-butyl-4-4-tert-butyl phenyl benzene,di-t-butylbiphenyl,pubchem9048,acmc-209st2,4,4'-di-tertbutylbiphenyl
IUPAC Name 1-tert-butyl-4-(4-tert-butylphenyl)benzene
InChI Key CDKCEZNPAYWORX-UHFFFAOYSA-N
Molecular Formula C20H26
11

4-n-Propylphenylacetylene, 97%

CAS: 62452-73-7 Molecular Formula: C11H12 Molecular Weight (g/mol): 144.217 MDL Number: MFCD00173886 InChI Key: UVFFOABHOIMLNB-UHFFFAOYSA-N Synonym: 4-propylphenylacetylene,1-eth-1-ynyl-4-propylbenzene,4-n-propylphenylacetylene,1-ethynyl-4-propyl-benzene,benzene, 1-ethynyl-4-propyl,pubchem10973,4-n-propylphenyl ethine,4-propyl phenylacetylene,4-ethynyl-1-propylbenzene,4-propyl-1-ethynylbenzene PubChem CID: 2775133 IUPAC Name: 1-ethynyl-4-propylbenzene SMILES: CCCC1=CC=C(C=C1)C#C

PubChem CID 2775133
CAS 62452-73-7
Molecular Weight (g/mol) 144.217
MDL Number MFCD00173886
SMILES CCCC1=CC=C(C=C1)C#C
Synonym 4-propylphenylacetylene,1-eth-1-ynyl-4-propylbenzene,4-n-propylphenylacetylene,1-ethynyl-4-propyl-benzene,benzene, 1-ethynyl-4-propyl,pubchem10973,4-n-propylphenyl ethine,4-propyl phenylacetylene,4-ethynyl-1-propylbenzene,4-propyl-1-ethynylbenzene
IUPAC Name 1-ethynyl-4-propylbenzene
InChI Key UVFFOABHOIMLNB-UHFFFAOYSA-N
Molecular Formula C11H12
12

alpha,alpha-Dimethylphenylacetic acid

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

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
13

4-tert-Butylphenylacetylene, 90+%

CAS: 772-38-3 Molecular Formula: C12H14 Molecular Weight (g/mol): 158.244 MDL Number: MFCD00190197 InChI Key: ZSYQVVKVKBVHIL-UHFFFAOYSA-N Synonym: 1-tert-butyl-4-ethynylbenzene,4-tert-butyl phenylacetylene,4-tert-butylphenylacetylene,benzene, 1-1,1-dimethylethyl-4-ethynyl,acmc-20amtx,4-t-butylphenylacetylene,4-tert-butylphenyl ethyne,4-tert.butylphenylacetylen,4-tert-butyl phenylethyne,4-tert-butylphenyl acetylene PubChem CID: 2757302 IUPAC Name: 1-tert-butyl-4-ethynylbenzene SMILES: CC(C)(C)C1=CC=C(C=C1)C#C

PubChem CID 2757302
CAS 772-38-3
Molecular Weight (g/mol) 158.244
MDL Number MFCD00190197
SMILES CC(C)(C)C1=CC=C(C=C1)C#C
Synonym 1-tert-butyl-4-ethynylbenzene,4-tert-butyl phenylacetylene,4-tert-butylphenylacetylene,benzene, 1-1,1-dimethylethyl-4-ethynyl,acmc-20amtx,4-t-butylphenylacetylene,4-tert-butylphenyl ethyne,4-tert.butylphenylacetylen,4-tert-butyl phenylethyne,4-tert-butylphenyl acetylene
IUPAC Name 1-tert-butyl-4-ethynylbenzene
InChI Key ZSYQVVKVKBVHIL-UHFFFAOYSA-N
Molecular Formula C12H14
14

alpha-Isopropylphenylacetic acid, 97%

CAS: 3508-94-9 Molecular Formula: C11H14O2 Molecular Weight (g/mol): 178.231 MDL Number: MFCD00021708 InChI Key: HDLQGISFYDYWFJ-UHFFFAOYSA-N Synonym: alpha-isopropylphenylacetic acid,2-isopropyl-2-phenylacetic acid,3-methyl-2-phenyl-butyric acid,3-methyl-2-phenylbutyric acid,butyric acid, 3-methyl-2-phenyl,benzeneacetic acid, alpha-1-methylethyl,2-phenylisovaleric acid,acmc-1bn3m,benzeneacetic acid, alpha-1-methylethyl-9ci,alpha-isopropylphenylaceticacid PubChem CID: 19024 IUPAC Name: 3-methyl-2-phenylbutanoic acid SMILES: CC(C)C(C1=CC=CC=C1)C(=O)O

PubChem CID 19024
CAS 3508-94-9
Molecular Weight (g/mol) 178.231
MDL Number MFCD00021708
SMILES CC(C)C(C1=CC=CC=C1)C(=O)O
Synonym alpha-isopropylphenylacetic acid,2-isopropyl-2-phenylacetic acid,3-methyl-2-phenyl-butyric acid,3-methyl-2-phenylbutyric acid,butyric acid, 3-methyl-2-phenyl,benzeneacetic acid, alpha-1-methylethyl,2-phenylisovaleric acid,acmc-1bn3m,benzeneacetic acid, alpha-1-methylethyl-9ci,alpha-isopropylphenylaceticacid
IUPAC Name 3-methyl-2-phenylbutanoic acid
InChI Key HDLQGISFYDYWFJ-UHFFFAOYSA-N
Molecular Formula C11H14O2
15

2-Methyl-1-phenyl-2-propen-1-ol, tech. 85%

CAS: 4383-08-8 Molecular Formula: C10H12O Molecular Weight (g/mol): 148.21 MDL Number: MFCD00046630 InChI Key: ZGYBYYJGIKPBFD-UHFFFAOYNA-N Synonym: 2-methyl-1-phenyl-2-propen-1-ol,acmc-1bn9z,alpha-isopropenylbenzenemethanol,1-phenyl-2-methyl-2-propen-1-ol,2,6-dichloro-9-methyl-10h-purine PubChem CID: 138211 IUPAC Name: 2-methyl-1-phenylprop-2-en-1-ol SMILES: CC(=C)C(C1=CC=CC=C1)O

PubChem CID 138211
CAS 4383-08-8
Molecular Weight (g/mol) 148.21
MDL Number MFCD00046630
SMILES CC(=C)C(C1=CC=CC=C1)O
Synonym 2-methyl-1-phenyl-2-propen-1-ol,acmc-1bn9z,alpha-isopropenylbenzenemethanol,1-phenyl-2-methyl-2-propen-1-ol,2,6-dichloro-9-methyl-10h-purine
IUPAC Name 2-methyl-1-phenylprop-2-en-1-ol
InChI Key ZGYBYYJGIKPBFD-UHFFFAOYNA-N
Molecular Formula C10H12O