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

Details

Stereochemistry ABSOLUTE
Molecular Formula C12H20O2
Molecular Weight 196.286
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of .ALPHA.-TERPINYL ACETATE, (+)-

SMILES

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

InChI

InChIKey=IGODOXYLBBXFDW-NSHDSACASA-N
InChI=1S/C12H20O2/c1-9-5-7-11(8-6-9)12(3,4)14-10(2)13/h5,11H,6-8H2,1-4H3/t11-/m0/s1

HIDE SMILES / InChI

Molecular Formula C12H20O2
Molecular Weight 196.286
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 Fri Dec 15 20:17:58 GMT 2023
Edited
by admin
on Fri Dec 15 20:17:58 GMT 2023
Record UNII
T3M2S9HES8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
.ALPHA.-TERPINYL ACETATE, (+)-
Common Name English
3-CYCLOHEXENE-1-METHANOL, .ALPHA.,.ALPHA.,4-TRIMETHYL-, 1-ACETATE, (1R)-
Common Name English
FEMA NO. 3047, (.ALPHA., +)-
Code English
P-MENTH-1-EN-8-OL, ACETATE, (+)-
Systematic Name English
(+)-.ALPHA.-TERPINYL ACETATE
Common Name English
3-CYCLOHEXENE-1-METHANOL, .ALPHA.,.ALPHA.,4-TRIMETHYL-, ACETATE, (1R)-
Systematic Name English
3-CYCLOHEXENE-1-METHANOL, .ALPHA.,.ALPHA.,4-TRIMETHYL-, ACETATE, (R)-
Systematic Name English
(R)-.ALPHA.-TERPINYL ACETATE
Common Name English
Code System Code Type Description
PUBCHEM
11469649
Created by admin on Fri Dec 15 20:17:58 GMT 2023 , Edited by admin on Fri Dec 15 20:17:58 GMT 2023
PRIMARY
DAILYMED
T3M2S9HES8
Created by admin on Fri Dec 15 20:17:58 GMT 2023 , Edited by admin on Fri Dec 15 20:17:58 GMT 2023
PRIMARY
ECHA (EC/EINECS)
232-082-0
Created by admin on Fri Dec 15 20:17:58 GMT 2023 , Edited by admin on Fri Dec 15 20:17:58 GMT 2023
PRIMARY
CAS
7785-54-8
Created by admin on Fri Dec 15 20:17:58 GMT 2023 , Edited by admin on Fri Dec 15 20:17:58 GMT 2023
PRIMARY
EPA CompTox
DTXSID001014412
Created by admin on Fri Dec 15 20:17:58 GMT 2023 , Edited by admin on Fri Dec 15 20:17:58 GMT 2023
PRIMARY
FDA UNII
T3M2S9HES8
Created by admin on Fri Dec 15 20:17:58 GMT 2023 , Edited by admin on Fri Dec 15 20:17:58 GMT 2023
PRIMARY