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

Details

Stereochemistry RACEMIC
Molecular Formula C8H16O2
Molecular Weight 144.2114
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,2-Cyclohexanedimethanol, (1R,2S)-rel-

SMILES

OC[C@H]1CCCC[C@H]1CO

InChI

InChIKey=XDODWINGEHBYRT-OCAPTIKFSA-N
InChI=1S/C8H16O2/c9-5-7-3-1-2-4-8(7)6-10/h7-10H,1-6H2/t7-,8+

HIDE SMILES / InChI

Molecular Formula C8H16O2
Molecular Weight 144.2114
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 Wed Apr 02 12:15:06 GMT 2025
Edited
by admin
on Wed Apr 02 12:15:06 GMT 2025
Record UNII
ALJ6CW3JCQ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,2-Cyclohexanedimethanol, (1R,2S)-rel-
Systematic Name English
(1R,2S)-REL-1,2-CYCLOHEXANEDIMETHANOL
Preferred Name English
CIS-1,2-BIS(HYDROXYMETHYL)CYCLOHEXANE
Systematic Name English
1,2-CYCLOHEXANEDIMETHANOL, CIS-
Systematic Name English
(CIS-2-HYDROXYMETHYLCYCLOHEXYL)METHANOL
Systematic Name English
REL-(1R,2S)-1,2-CYCLOHEXANEDIMETHANOL
Systematic Name English
CIS-1,2-CYCLOHEXANEDIMETHANOL
Systematic Name English
1,2-CIS-CYCLOHEXANEDIMETHANOL
Systematic Name English
Code System Code Type Description
FDA UNII
ALJ6CW3JCQ
Created by admin on Wed Apr 02 12:15:06 GMT 2025 , Edited by admin on Wed Apr 02 12:15:06 GMT 2025
PRIMARY
CAS
15753-50-1
Created by admin on Wed Apr 02 12:15:06 GMT 2025 , Edited by admin on Wed Apr 02 12:15:06 GMT 2025
PRIMARY
EPA CompTox
DTXSID70935698
Created by admin on Wed Apr 02 12:15:06 GMT 2025 , Edited by admin on Wed Apr 02 12:15:06 GMT 2025
PRIMARY
PUBCHEM
2724019
Created by admin on Wed Apr 02 12:15:06 GMT 2025 , Edited by admin on Wed Apr 02 12:15:06 GMT 2025
PRIMARY