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

Details

Stereochemistry ACHIRAL
Molecular Formula C11H10O2
Molecular Weight 174.1959
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-METHYLINDENE-2-CARBOXYLIC ACID

SMILES

CC1=C(CC2=C1C=CC=C2)C(O)=O

InChI

InChIKey=RONBYWGSEXDEKC-UHFFFAOYSA-N
InChI=1S/C11H10O2/c1-7-9-5-3-2-4-8(9)6-10(7)11(12)13/h2-5H,6H2,1H3,(H,12,13)

HIDE SMILES / InChI

Molecular Formula C11H10O2
Molecular Weight 174.1959
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 12:32:52 GMT 2023
Edited
by admin
on Sat Dec 16 12:32:52 GMT 2023
Record UNII
8CUV9E9RQM
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-METHYLINDENE-2-CARBOXYLIC ACID
Systematic Name English
3-METHYL-1H-INDENE-2-CARBOXYLIC ACID
Systematic Name English
Code System Code Type Description
PUBCHEM
118616
Created by admin on Sat Dec 16 12:32:52 GMT 2023 , Edited by admin on Sat Dec 16 12:32:52 GMT 2023
PRIMARY
ECHA (EC/EINECS)
251-888-3
Created by admin on Sat Dec 16 12:32:52 GMT 2023 , Edited by admin on Sat Dec 16 12:32:52 GMT 2023
PRIMARY
CAS
34225-81-5
Created by admin on Sat Dec 16 12:32:52 GMT 2023 , Edited by admin on Sat Dec 16 12:32:52 GMT 2023
PRIMARY
FDA UNII
8CUV9E9RQM
Created by admin on Sat Dec 16 12:32:52 GMT 2023 , Edited by admin on Sat Dec 16 12:32:52 GMT 2023
PRIMARY
EPA CompTox
DTXSID20187807
Created by admin on Sat Dec 16 12:32:52 GMT 2023 , Edited by admin on Sat Dec 16 12:32:52 GMT 2023
PRIMARY