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

Details

Stereochemistry ACHIRAL
Molecular Formula C13H12O8
Molecular Weight 296.2296
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3,4,5-Triacetoxybenzoic acid

SMILES

CC(=O)OC1=CC(=CC(OC(C)=O)=C1OC(C)=O)C(O)=O

InChI

InChIKey=BJCGLAAQSUGMKB-UHFFFAOYSA-N
InChI=1S/C13H12O8/c1-6(14)19-10-4-9(13(17)18)5-11(20-7(2)15)12(10)21-8(3)16/h4-5H,1-3H3,(H,17,18)

HIDE SMILES / InChI

Molecular Formula C13H12O8
Molecular Weight 296.2296
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 13:06:50 GMT 2023
Edited
by admin
on Sat Dec 16 13:06:50 GMT 2023
Record UNII
2TPZ8W7SN9
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3,4,5-Triacetoxybenzoic acid
Systematic Name English
3,4,5-Triacetyloxybenzoic acid
Systematic Name English
3,4,5-Tris(acetyloxy)benzoic acid
Systematic Name English
NSC-49173
Code English
Benzoic acid, 3,4,5-tris(acetyloxy)-
Systematic Name English
NSC-16959
Code English
Gallic acid, triacetate
Systematic Name English
Code System Code Type Description
FDA UNII
2TPZ8W7SN9
Created by admin on Sat Dec 16 13:06:51 GMT 2023 , Edited by admin on Sat Dec 16 13:06:51 GMT 2023
PRIMARY
EPA CompTox
DTXSID40216562
Created by admin on Sat Dec 16 13:06:51 GMT 2023 , Edited by admin on Sat Dec 16 13:06:51 GMT 2023
PRIMARY
CAS
6635-24-1
Created by admin on Sat Dec 16 13:06:51 GMT 2023 , Edited by admin on Sat Dec 16 13:06:51 GMT 2023
PRIMARY
NSC
16959
Created by admin on Sat Dec 16 13:06:51 GMT 2023 , Edited by admin on Sat Dec 16 13:06:51 GMT 2023
PRIMARY
NSC
49173
Created by admin on Sat Dec 16 13:06:51 GMT 2023 , Edited by admin on Sat Dec 16 13:06:51 GMT 2023
PRIMARY
PUBCHEM
95088
Created by admin on Sat Dec 16 13:06:51 GMT 2023 , Edited by admin on Sat Dec 16 13:06:51 GMT 2023
PRIMARY