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

Details

Stereochemistry RACEMIC
Molecular Formula C12H16O
Molecular Weight 176.2548
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-PHENYLCYCLOHEXANOL, TRANS-

SMILES

O[C@@H]1CCCC[C@H]1C2=CC=CC=C2

InChI

InChIKey=AAIBYZBZXNWTPP-NWDGAFQWSA-N
InChI=1S/C12H16O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-3,6-7,11-13H,4-5,8-9H2/t11-,12+/m0/s1

HIDE SMILES / InChI

Molecular Formula C12H16O
Molecular Weight 176.2548
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 17:36:01 UTC 2023
Edited
by admin
on Sat Dec 16 17:36:01 UTC 2023
Record UNII
452WZ637M8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-PHENYLCYCLOHEXANOL, TRANS-
Systematic Name English
TRANS-2-PHENYL-1-CYCLOHEXANOL
Systematic Name English
CYCLOHEXANOL, 2-PHENYL-, (1R,2S)-REL-
Common Name English
(±)-TRANS-2-PHENYLCYCLOHEXANOL
Systematic Name English
(1S*,2R*)-2-PHENYLCYCLOHEXANOL
Systematic Name English
CYCLOHEXANOL, 2-PHENYL-, TRANS-
Systematic Name English
TRANS-2-PHENYLCYCLOHEXANOL
Systematic Name English
(±)-TRANS-2-PHENYL-1-CYCLOHEXANOL
Systematic Name English
Code System Code Type Description
CAS
2362-61-0
Created by admin on Sat Dec 16 17:36:01 UTC 2023 , Edited by admin on Sat Dec 16 17:36:01 UTC 2023
PRIMARY
FDA UNII
452WZ637M8
Created by admin on Sat Dec 16 17:36:01 UTC 2023 , Edited by admin on Sat Dec 16 17:36:01 UTC 2023
PRIMARY
EPA CompTox
DTXSID6022185
Created by admin on Sat Dec 16 17:36:01 UTC 2023 , Edited by admin on Sat Dec 16 17:36:01 UTC 2023
PRIMARY
ECHA (EC/EINECS)
219-111-2
Created by admin on Sat Dec 16 17:36:01 UTC 2023 , Edited by admin on Sat Dec 16 17:36:01 UTC 2023
PRIMARY