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

Details

Stereochemistry ABSOLUTE
Molecular Formula C10H18O
Molecular Weight 154.2493
Optical Activity UNSPECIFIED
Defined Stereocenters 3 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of NEOISODIHYDROCARVEOL, (+)-

SMILES

C[C@H]1CC[C@H](C[C@H]1O)C(C)=C

InChI

InChIKey=KRCZYMFUWVJCLI-IVZWLZJFSA-N
InChI=1S/C10H18O/c1-7(2)9-5-4-8(3)10(11)6-9/h8-11H,1,4-6H2,2-3H3/t8-,9+,10+/m0/s1

HIDE SMILES / InChI

Molecular Formula C10H18O
Molecular Weight 154.2493
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 3 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 19:50:48 GMT 2025
Edited
by admin
on Tue Apr 01 19:50:48 GMT 2025
Record UNII
A3V1C5WF34
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NEOISODIHYDROCARVEOL, (+)-
Common Name English
(+)-NEOISODIHYDROCARVEOL
Preferred Name English
CYCLOHEXANOL, 2-METHYL-5-(1-METHYLETHENYL)-, (1R-(1.ALPHA.,2.ALPHA.,5.ALPHA.))-
Systematic Name English
(1R,2S,5R)-2-METHYL-5-(1-METHYLETHENYL)CYCLOHEXANOL
Systematic Name English
CYCLOHEXANOL, 2-METHYL-5-(1-METHYLETHENYL)-, (1R,2S,5R)-
Systematic Name English
(1R,2S,5R)-5-ISOPROPENYL-2-METHYLCYCLOHEXANOL
Systematic Name English
Code System Code Type Description
CHEBI
50232
Created by admin on Tue Apr 01 19:50:48 GMT 2025 , Edited by admin on Tue Apr 01 19:50:48 GMT 2025
PRIMARY
FDA UNII
A3V1C5WF34
Created by admin on Tue Apr 01 19:50:48 GMT 2025 , Edited by admin on Tue Apr 01 19:50:48 GMT 2025
PRIMARY
CAS
51773-45-6
Created by admin on Tue Apr 01 19:50:48 GMT 2025 , Edited by admin on Tue Apr 01 19:50:48 GMT 2025
PRIMARY
EPA CompTox
DTXSID601224883
Created by admin on Tue Apr 01 19:50:48 GMT 2025 , Edited by admin on Tue Apr 01 19:50:48 GMT 2025
PRIMARY
PUBCHEM
443166
Created by admin on Tue Apr 01 19:50:48 GMT 2025 , Edited by admin on Tue Apr 01 19:50:48 GMT 2025
PRIMARY