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

Details

Stereochemistry ABSOLUTE
Molecular Formula C10H18O2
Molecular Weight 170.2487
Optical Activity ( + )
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-(2-Hydroxy-2-propyl)cyclohexene-1-methanol, (R)-

SMILES

CC(C)(O)[C@@H]1CCC(CO)=CC1

InChI

InChIKey=XYKGEKWHBMLSGS-VIFPVBQESA-N
InChI=1S/C10H18O2/c1-10(2,12)9-5-3-8(7-11)4-6-9/h3,9,11-12H,4-7H2,1-2H3/t9-/m0/s1

HIDE SMILES / InChI

Molecular Formula C10H18O2
Molecular Weight 170.2487
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 Wed Apr 02 10:21:43 GMT 2025
Edited
by admin
on Wed Apr 02 10:21:43 GMT 2025
Record UNII
P2VC2C4TLU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-Cyclohexene-1,4-dimethanol, ?<sup>4</sup>,?<sup>4</sup>-dimethyl-, (R)-
Preferred Name English
4-(2-Hydroxy-2-propyl)cyclohexene-1-methanol, (R)-
Systematic Name English
2-[(1R)-4-(Hydroxymethyl)cyclohex-3-en-1-yl]propan-2-ol
Systematic Name English
Code System Code Type Description
FDA UNII
P2VC2C4TLU
Created by admin on Wed Apr 02 10:21:43 GMT 2025 , Edited by admin on Wed Apr 02 10:21:43 GMT 2025
PRIMARY
PUBCHEM
92261436
Created by admin on Wed Apr 02 10:21:43 GMT 2025 , Edited by admin on Wed Apr 02 10:21:43 GMT 2025
PRIMARY
CAS
83921-02-2
Created by admin on Wed Apr 02 10:21:43 GMT 2025 , Edited by admin on Wed Apr 02 10:21:43 GMT 2025
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER