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Details

Stereochemistry RACEMIC
Molecular Formula C12H18O
Molecular Weight 178.2707
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of .ALPHA.-ISOBUTYLPHENETHYL ALCOHOL

SMILES

CC(C)CC(O)CC1=CC=CC=C1

InChI

InChIKey=IUADYGVMSDKSMB-UHFFFAOYSA-N
InChI=1S/C12H18O/c1-10(2)8-12(13)9-11-6-4-3-5-7-11/h3-7,10,12-13H,8-9H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C12H18O
Molecular Weight 178.2707
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 17:04:40 UTC 2023
Edited
by admin
on Fri Dec 15 17:04:40 UTC 2023
Record UNII
2SBL0E1I0N
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
.ALPHA.-ISOBUTYLPHENETHYL ALCOHOL
FHFI  
Systematic Name English
ISOBUTYL BENZYL CARBINOL
Systematic Name English
2-PENTANOL, 4-METHYL-1-PHENYL-
Systematic Name English
FEMA NO. 2208
Code English
4-METHYL-1-PHENYL-2-PENTANOL
Systematic Name English
BENZENEETHANOL, .ALPHA.-(2-METHYLPROPYL)-
Systematic Name English
PHENETHYL ALCOHOL, .ALPHA.-ISOBUTYL-
Systematic Name English
.ALPHA.-ISOBUTYLPHENETHYL ALCOHOL [FHFI]
Common Name English
4-METHYL-1-PHENYLPENTAN-2-OL
Systematic Name English
Classification Tree Code System Code
CFR 21 CFR 172.515
Created by admin on Fri Dec 15 17:04:40 UTC 2023 , Edited by admin on Fri Dec 15 17:04:40 UTC 2023
Code System Code Type Description
FDA UNII
2SBL0E1I0N
Created by admin on Fri Dec 15 17:04:40 UTC 2023 , Edited by admin on Fri Dec 15 17:04:40 UTC 2023
PRIMARY
JECFA MONOGRAPH
759
Created by admin on Fri Dec 15 17:04:40 UTC 2023 , Edited by admin on Fri Dec 15 17:04:40 UTC 2023
PRIMARY
ECHA (EC/EINECS)
231-939-6
Created by admin on Fri Dec 15 17:04:40 UTC 2023 , Edited by admin on Fri Dec 15 17:04:40 UTC 2023
PRIMARY
CAS
7779-78-4
Created by admin on Fri Dec 15 17:04:40 UTC 2023 , Edited by admin on Fri Dec 15 17:04:40 UTC 2023
PRIMARY
DAILYMED
2SBL0E1I0N
Created by admin on Fri Dec 15 17:04:40 UTC 2023 , Edited by admin on Fri Dec 15 17:04:40 UTC 2023
PRIMARY
RXCUI
1720936
Created by admin on Fri Dec 15 17:04:40 UTC 2023 , Edited by admin on Fri Dec 15 17:04:40 UTC 2023
PRIMARY
PUBCHEM
62661
Created by admin on Fri Dec 15 17:04:40 UTC 2023 , Edited by admin on Fri Dec 15 17:04:40 UTC 2023
PRIMARY
MESH
C039407
Created by admin on Fri Dec 15 17:04:40 UTC 2023 , Edited by admin on Fri Dec 15 17:04:40 UTC 2023
PRIMARY
EPA CompTox
DTXSID8047717
Created by admin on Fri Dec 15 17:04:40 UTC 2023 , Edited by admin on Fri Dec 15 17:04:40 UTC 2023
PRIMARY