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

Details

Stereochemistry ACHIRAL
Molecular Formula C11H12Cl3NO
Molecular Weight 280.578
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(Bis(2-chloroethyl)amino)benzoyl chloride

SMILES

ClCCN(CCCl)C1=CC(=CC=C1)C(Cl)=O

InChI

InChIKey=DAHGLNLVALQWNU-UHFFFAOYSA-N
InChI=1S/C11H12Cl3NO/c12-4-6-15(7-5-13)10-3-1-2-9(8-10)11(14)16/h1-3,8H,4-7H2

HIDE SMILES / InChI

Approval Year

Name Type Language
3-(Bis(2-chloroethyl)amino)benzoyl chloride
Systematic Name English
Benzoyl chloride, m-(bis(2-chloroethyl)amino)-
Systematic Name English
NSC-240369
Code English
Benzoyl chloride, 3-(bis(2-chloroethyl)amino)-
Systematic Name English
m-(Bis(2-chloroethyl)amino)benzoyl chloride
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID70179510
Created by admin on Sat Dec 16 12:42:52 GMT 2023 , Edited by admin on Sat Dec 16 12:42:52 GMT 2023
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CAS
24813-11-4
Created by admin on Sat Dec 16 12:42:52 GMT 2023 , Edited by admin on Sat Dec 16 12:42:52 GMT 2023
PRIMARY
NSC
240369
Created by admin on Sat Dec 16 12:42:52 GMT 2023 , Edited by admin on Sat Dec 16 12:42:52 GMT 2023
PRIMARY
FDA UNII
ZW5YW7YTH9
Created by admin on Sat Dec 16 12:42:52 GMT 2023 , Edited by admin on Sat Dec 16 12:42:52 GMT 2023
PRIMARY
PUBCHEM
32678
Created by admin on Sat Dec 16 12:42:52 GMT 2023 , Edited by admin on Sat Dec 16 12:42:52 GMT 2023
PRIMARY