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

Details

Stereochemistry MIXED
Molecular Formula C11H20O2
Molecular Weight 184.2753
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3,3,5-TRIMETHYLCYCLOHEXYL ACETATE

SMILES

CC1CC(CC(C)(C)C1)OC(C)=O

InChI

InChIKey=OIVWFAFCHQDCCG-UHFFFAOYSA-N
InChI=1S/C11H20O2/c1-8-5-10(13-9(2)12)7-11(3,4)6-8/h8,10H,5-7H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C11H20O2
Molecular Weight 184.2753
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 01:21:35 GMT 2023
Edited
by admin
on Sat Dec 16 01:21:35 GMT 2023
Record UNII
QDX18ED83B
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3,3,5-TRIMETHYLCYCLOHEXYL ACETATE
Systematic Name English
HOMOMENTHOL ACETATE
Common Name English
CYCLOHEXANOL, 3,3,5-TRIMETHYL-, ACETATE
Systematic Name English
FEMA NO. 4512
Code English
HOMOMENTHYL ACETATE
Common Name English
3,3,5-TRIMETHYLCYCLOHEXYL ACETATE, (±)-
Systematic Name English
(±)-3,3,5-TRIMETHYLCYCLOHEXYL ACETATE
Systematic Name English
CYCLOHEXANOL, 3,3,5-TRIMETHYL-, 1-ACETATE
Common Name English
Code System Code Type Description
FDA UNII
QDX18ED83B
Created by admin on Sat Dec 16 01:21:35 GMT 2023 , Edited by admin on Sat Dec 16 01:21:35 GMT 2023
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CAS
67859-96-5
Created by admin on Sat Dec 16 01:21:35 GMT 2023 , Edited by admin on Sat Dec 16 01:21:35 GMT 2023
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ECHA (EC/EINECS)
267-430-0
Created by admin on Sat Dec 16 01:21:35 GMT 2023 , Edited by admin on Sat Dec 16 01:21:35 GMT 2023
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JECFA MONOGRAPH
2030
Created by admin on Sat Dec 16 01:21:35 GMT 2023 , Edited by admin on Sat Dec 16 01:21:35 GMT 2023
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EPA CompTox
DTXSID30867365
Created by admin on Sat Dec 16 01:21:35 GMT 2023 , Edited by admin on Sat Dec 16 01:21:35 GMT 2023
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PUBCHEM
106917
Created by admin on Sat Dec 16 01:21:35 GMT 2023 , Edited by admin on Sat Dec 16 01:21:35 GMT 2023
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