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

Details

Stereochemistry ACHIRAL
Molecular Formula C11H12O4
Molecular Weight 208.2106
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-Allyloxy-m-anisic acid

SMILES

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

InChI

InChIKey=YOAIHTMTCQXBPI-UHFFFAOYSA-N
InChI=1S/C11H12O4/c1-3-7-15-10-8(11(12)13)5-4-6-9(10)14-2/h3-6H,1,7H2,2H3,(H,12,13)

HIDE SMILES / InChI

Molecular Formula C11H12O4
Molecular Weight 208.2106
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 Tue Apr 01 19:11:49 GMT 2025
Edited
by admin
on Tue Apr 01 19:11:49 GMT 2025
Record UNII
2E7PPL24PH
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-Methoxy-2-(2-propen-1-yloxy)benzoic acid
Preferred Name English
2-Allyloxy-m-anisic acid
Systematic Name English
Benzoic acid, 3-methoxy-2-(2-propen-1-yloxy)-
Systematic Name English
Code System Code Type Description
CAS
96619-88-4
Created by admin on Tue Apr 01 19:11:49 GMT 2025 , Edited by admin on Tue Apr 01 19:11:49 GMT 2025
PRIMARY
EPA CompTox
DTXSID10242373
Created by admin on Tue Apr 01 19:11:49 GMT 2025 , Edited by admin on Tue Apr 01 19:11:49 GMT 2025
PRIMARY
PUBCHEM
3024603
Created by admin on Tue Apr 01 19:11:49 GMT 2025 , Edited by admin on Tue Apr 01 19:11:49 GMT 2025
PRIMARY
ECHA (EC/EINECS)
306-200-7
Created by admin on Tue Apr 01 19:11:49 GMT 2025 , Edited by admin on Tue Apr 01 19:11:49 GMT 2025
PRIMARY
FDA UNII
2E7PPL24PH
Created by admin on Tue Apr 01 19:11:49 GMT 2025 , Edited by admin on Tue Apr 01 19:11:49 GMT 2025
PRIMARY