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Details

Stereochemistry ACHIRAL
Molecular Formula C11H14O3
Molecular Weight 194.2271
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of GUAIACOL ISOBUTYRATE

SMILES

COC1=C(OC(=O)C(C)C)C=CC=C1

InChI

InChIKey=YXJFCJJDNPANPU-UHFFFAOYSA-N
InChI=1S/C11H14O3/c1-8(2)11(12)14-10-7-5-4-6-9(10)13-3/h4-8H,1-3H3

HIDE SMILES / InChI

Molecular Formula C11H14O3
Molecular Weight 194.2271
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 Mon Mar 31 20:33:05 GMT 2025
Edited
by admin
on Mon Mar 31 20:33:05 GMT 2025
Record UNII
33495443UT
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FEMA NO. 4608
Preferred Name English
GUAIACOL ISOBUTYRATE
Systematic Name English
GUAIACYL ISOBUTYRATE
Common Name English
2-METHOXYPHENYL-2-METHYL PROPANOATE
Common Name English
2-METHOXYPHENYL ISOBUTYRATE
Systematic Name English
PROPANOIC ACID, 2-METHYL-, 2-METHOXYPHENYL ESTER
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID80222682
Created by admin on Mon Mar 31 20:33:05 GMT 2025 , Edited by admin on Mon Mar 31 20:33:05 GMT 2025
PRIMARY
FDA UNII
33495443UT
Created by admin on Mon Mar 31 20:33:05 GMT 2025 , Edited by admin on Mon Mar 31 20:33:05 GMT 2025
PRIMARY
JECFA MONOGRAPH
1994
Created by admin on Mon Mar 31 20:33:05 GMT 2025 , Edited by admin on Mon Mar 31 20:33:05 GMT 2025
PRIMARY
CAS
723759-62-4
Created by admin on Mon Mar 31 20:33:05 GMT 2025 , Edited by admin on Mon Mar 31 20:33:05 GMT 2025
PRIMARY
PUBCHEM
836904
Created by admin on Mon Mar 31 20:33:05 GMT 2025 , Edited by admin on Mon Mar 31 20:33:05 GMT 2025
PRIMARY