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Details

Stereochemistry RACEMIC
Molecular Formula C9H12O
Molecular Weight 136.191
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-PHENYL-2-PROPANOL

SMILES

CC(O)CC1=CC=CC=C1

InChI

InChIKey=WYTRYIUQUDTGSX-UHFFFAOYSA-N
InChI=1S/C9H12O/c1-8(10)7-9-5-3-2-4-6-9/h2-6,8,10H,7H2,1H3

HIDE SMILES / InChI

Molecular Formula C9H12O
Molecular Weight 136.191
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

PubMed

PubMed

TitleDatePubMed
Rotational spectra and conformational structures of 1-phenyl-2-propanol, methamphetamine, and 1-phenyl-2-propanone.
2006 Dec 14
Enantioseparation of secondary alcohols by diastereoisomeric salt formation.
2006 Feb
Purification and characterization of alcohol dehydrogenase reducing N-benzyl-3-pyrrolidinone from Geotrichum capitatum.
2007 Feb
A Thermoanaerobacter ethanolicus secondary alcohol dehydrogenase mutant derivative highly active and stereoselective on phenylacetone and benzylacetone.
2007 Feb
The FEMA GRAS assessment of aromatic substituted secondary alcohols, ketones, and related esters used as flavor ingredients.
2007 Feb
Improved synthesis of (S)-1-phenyl-2-propanol in high concentration with coupled whole cells of Rhodococcus erythropolis and Bacillus subtilis on preparative scale.
2010 Nov
Patents
Substance Class Chemical
Created
by admin
on Wed Jul 05 23:30:19 UTC 2023
Edited
by admin
on Wed Jul 05 23:30:19 UTC 2023
Record UNII
300Y7TB8EY
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-PHENYL-2-PROPANOL
Systematic Name English
(±)-.ALPHA.-METHYLBENZENEETHANOL
Systematic Name English
NSC-53553
Code English
.ALPHA.-METHYLPHENETHYL ALCOHOL
Systematic Name English
DEXTROAMPHETAMINE RELATED COMPOUND A [USP IMPURITY]
Common Name English
DEXTROAMPHETAMINE RELATED COMPOUND A [USP-RS]
Common Name English
BENZYLETHYL ALCOHOL
Systematic Name English
DEXTROAMPHETAMINE RELATED COMPOUND A
USP   USP-RS  
Common Name English
2-HYDROXY-1-PHENYLPROPANE
Systematic Name English
2-PROPANOL, 1-PHENYL-
Systematic Name English
BENZYL METHYL CARBINOL
Systematic Name English
3-PHENYL-2-HYDROXYPROPANE
Systematic Name English
AMFETAMINE SULFATE IMPURITY A [EP IMPURITY]
Common Name English
.ALPHA.-METHYLBENZENEETHANOL
Systematic Name English
3-PHENYL-2-PROPANOL
Systematic Name English
(±)-1-PHENYLPROPAN-2-OL
Systematic Name English
(±)-.ALPHA.-METHYLPHENETHYL ALCOHOL
Systematic Name English
BENZENEETHANOL, .ALPHA.-METHYL-
Systematic Name English
Code System Code Type Description
NSC
53553
Created by admin on Wed Jul 05 23:30:19 UTC 2023 , Edited by admin on Wed Jul 05 23:30:19 UTC 2023
PRIMARY
RS_ITEM_NUM
1180015
Created by admin on Wed Jul 05 23:30:19 UTC 2023 , Edited by admin on Wed Jul 05 23:30:19 UTC 2023
PRIMARY
EPA CompTox
DTXSID70862379
Created by admin on Wed Jul 05 23:30:19 UTC 2023 , Edited by admin on Wed Jul 05 23:30:19 UTC 2023
PRIMARY
FDA UNII
300Y7TB8EY
Created by admin on Wed Jul 05 23:30:19 UTC 2023 , Edited by admin on Wed Jul 05 23:30:19 UTC 2023
PRIMARY
ECHA (EC/EINECS)
211-821-0
Created by admin on Wed Jul 05 23:30:19 UTC 2023 , Edited by admin on Wed Jul 05 23:30:19 UTC 2023
PRIMARY
CAS
698-87-3
Created by admin on Wed Jul 05 23:30:19 UTC 2023 , Edited by admin on Wed Jul 05 23:30:19 UTC 2023
PRIMARY
PUBCHEM
94185
Created by admin on Wed Jul 05 23:30:19 UTC 2023 , Edited by admin on Wed Jul 05 23:30:19 UTC 2023
PRIMARY
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