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

Details

Stereochemistry ACHIRAL
Molecular Formula C8H5ClO3
Molecular Weight 184.577
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6-Chloropiperonal

SMILES

ClC1=CC2=C(OCO2)C=C1C=O

InChI

InChIKey=VRNADRCOROWLJC-UHFFFAOYSA-N
InChI=1S/C8H5ClO3/c9-6-2-8-7(11-4-12-8)1-5(6)3-10/h1-3H,4H2

HIDE SMILES / InChI

Approval Year

Name Type Language
NSC-166400
Preferred Name English
6-Chloropiperonal
Common Name English
6-Chloro-1,3-benzodioxole-5-carboxaldehyde
Systematic Name English
2-Chloro-4,5-methylenedioxybenzaldehyde
Systematic Name English
6-Chlorobenzodioxole-5-carboxaldehyde
Systematic Name English
1,3-Benzodioxole-5-carboxaldehyde, 6-chloro-
Systematic Name English
Code System Code Type Description
FDA UNII
FLN3X72UKA
Created by admin on Wed Apr 02 19:44:19 GMT 2025 , Edited by admin on Wed Apr 02 19:44:19 GMT 2025
PRIMARY
EPA CompTox
DTXSID40166674
Created by admin on Wed Apr 02 19:44:19 GMT 2025 , Edited by admin on Wed Apr 02 19:44:19 GMT 2025
PRIMARY
PUBCHEM
140014
Created by admin on Wed Apr 02 19:44:19 GMT 2025 , Edited by admin on Wed Apr 02 19:44:19 GMT 2025
PRIMARY
CAS
15952-61-1
Created by admin on Wed Apr 02 19:44:19 GMT 2025 , Edited by admin on Wed Apr 02 19:44:19 GMT 2025
PRIMARY