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Details

Stereochemistry ACHIRAL
Molecular Formula C12H16O2
Molecular Weight 192.2542
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Cuminyl acetate

SMILES

CC(C)C1=CC=C(COC(C)=O)C=C1

InChI

InChIKey=QBCRVYRADYXNOW-UHFFFAOYSA-N
InChI=1S/C12H16O2/c1-9(2)12-6-4-11(5-7-12)8-14-10(3)13/h4-7,9H,8H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C12H16O2
Molecular Weight 192.2542
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:02:16 GMT 2023
Edited
by admin
on Sat Dec 16 08:02:16 GMT 2023
Record UNII
YDV7UWR262
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Cuminyl acetate
Systematic Name English
Benzenemethanol, 4-(1-methylethyl)-, 1-acetate
Systematic Name English
4-Isopropylbenzyl acetate
Systematic Name English
Code System Code Type Description
FDA UNII
YDV7UWR262
Created by admin on Sat Dec 16 08:02:16 GMT 2023 , Edited by admin on Sat Dec 16 08:02:16 GMT 2023
PRIMARY
EPA CompTox
DTXSID0052259
Created by admin on Sat Dec 16 08:02:16 GMT 2023 , Edited by admin on Sat Dec 16 08:02:16 GMT 2023
PRIMARY
PUBCHEM
100990
Created by admin on Sat Dec 16 08:02:16 GMT 2023 , Edited by admin on Sat Dec 16 08:02:16 GMT 2023
PRIMARY
ECHA (EC/EINECS)
261-671-5
Created by admin on Sat Dec 16 08:02:16 GMT 2023 , Edited by admin on Sat Dec 16 08:02:16 GMT 2023
PRIMARY
CAS
59230-57-8
Created by admin on Sat Dec 16 08:02:16 GMT 2023 , Edited by admin on Sat Dec 16 08:02:16 GMT 2023
PRIMARY