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

Details

Stereochemistry ACHIRAL
Molecular Formula C9H6Cl2O2
Molecular Weight 217.049
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 3,4-DICHLOROCINNAMIC ACID

SMILES

OC(=O)\C=C\C1=CC(Cl)=C(Cl)C=C1

InChI

InChIKey=RRLUFPHCTSFKNR-DUXPYHPUSA-N
InChI=1S/C9H6Cl2O2/c10-7-3-1-6(5-8(7)11)2-4-9(12)13/h1-5H,(H,12,13)/b4-2+

HIDE SMILES / InChI

Molecular Formula C9H6Cl2O2
Molecular Weight 217.049
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 17:46:11 GMT 2025
Edited
by admin
on Mon Mar 31 17:46:11 GMT 2025
Record UNII
480625A7SY
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-518800
Preferred Name English
3,4-DICHLOROCINNAMIC ACID
Systematic Name English
2-PROPENOIC ACID, 3-(3,4-DICHLOROPHENYL)-
Common Name English
CINNAMIC ACID, 3,4-DICHLORO-
Common Name English
3',4'-DICHLOROCINNAMIC ACID
Common Name English
Code System Code Type Description
FDA UNII
480625A7SY
Created by admin on Mon Mar 31 17:46:11 GMT 2025 , Edited by admin on Mon Mar 31 17:46:11 GMT 2025
PRIMARY
EPA CompTox
DTXSID101311887
Created by admin on Mon Mar 31 17:46:11 GMT 2025 , Edited by admin on Mon Mar 31 17:46:11 GMT 2025
PRIMARY
CAS
1202-39-7
Created by admin on Mon Mar 31 17:46:11 GMT 2025 , Edited by admin on Mon Mar 31 17:46:11 GMT 2025
PRIMARY
ECHA (EC/EINECS)
214-866-4
Created by admin on Mon Mar 31 17:46:11 GMT 2025 , Edited by admin on Mon Mar 31 17:46:11 GMT 2025
PRIMARY
NSC
518800
Created by admin on Mon Mar 31 17:46:11 GMT 2025 , Edited by admin on Mon Mar 31 17:46:11 GMT 2025
PRIMARY
PUBCHEM
688027
Created by admin on Mon Mar 31 17:46:11 GMT 2025 , Edited by admin on Mon Mar 31 17:46:11 GMT 2025
PRIMARY