U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C9H12O2
Molecular Weight 152.1904
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (2S)-3-PHENYLPROPANE-1,2-DIOL

SMILES

OC[C@@H](O)CC1=CC=CC=C1

InChI

InChIKey=JHWQMXKQJVAWKI-VIFPVBQESA-N
InChI=1S/C9H12O2/c10-7-9(11)6-8-4-2-1-3-5-8/h1-5,9-11H,6-7H2/t9-/m0/s1

HIDE SMILES / InChI

Molecular Formula C9H12O2
Molecular Weight 152.1904
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:35:28 GMT 2023
Edited
by admin
on Sat Dec 16 11:35:28 GMT 2023
Record UNII
6PQ7U3G5W6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(2S)-3-PHENYLPROPANE-1,2-DIOL
Systematic Name English
(-)-3-PHENYLPROPANE-1,2-DIOL
Systematic Name English
1,2-PROPANEDIOL, 3-PHENYL-, (2S)
Systematic Name English
(2S)-2-HYDROXY-3-PHENYL-1-PROPANOL
Systematic Name English
(2S)-3-PHENYL-1,2-PROPANEDIOL
Systematic Name English
Code System Code Type Description
DRUG BANK
DB02803
Created by admin on Sat Dec 16 11:35:28 GMT 2023 , Edited by admin on Sat Dec 16 11:35:28 GMT 2023
PRIMARY
CAS
61475-32-9
Created by admin on Sat Dec 16 11:35:28 GMT 2023 , Edited by admin on Sat Dec 16 11:35:28 GMT 2023
PRIMARY
FDA UNII
6PQ7U3G5W6
Created by admin on Sat Dec 16 11:35:28 GMT 2023 , Edited by admin on Sat Dec 16 11:35:28 GMT 2023
PRIMARY
RXCUI
2557900
Created by admin on Sat Dec 16 11:35:28 GMT 2023 , Edited by admin on Sat Dec 16 11:35:28 GMT 2023
PRIMARY
EPA CompTox
DTXSID00332212
Created by admin on Sat Dec 16 11:35:28 GMT 2023 , Edited by admin on Sat Dec 16 11:35:28 GMT 2023
PRIMARY
DAILYMED
6PQ7U3G5W6
Created by admin on Sat Dec 16 11:35:28 GMT 2023 , Edited by admin on Sat Dec 16 11:35:28 GMT 2023
PRIMARY
PUBCHEM
446127
Created by admin on Sat Dec 16 11:35:28 GMT 2023 , Edited by admin on Sat Dec 16 11:35:28 GMT 2023
PRIMARY