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Details

Stereochemistry ACHIRAL
Molecular Formula C12H17Cl2NO2
Molecular Weight 278.175
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N,N-Bis(2-chloroethyl)-2,3-dimethoxyaniline

SMILES

COC1=C(OC)C(=CC=C1)N(CCCl)CCCl

InChI

InChIKey=JMCCVSKJZKUSTH-UHFFFAOYSA-N
InChI=1S/C12H17Cl2NO2/c1-16-11-5-3-4-10(12(11)17-2)15(8-6-13)9-7-14/h3-5H,6-9H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C12H17Cl2NO2
Molecular Weight 278.175
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 13:11:56 GMT 2023
Edited
by admin
on Sat Dec 16 13:11:56 GMT 2023
Record UNII
KBX8M395BE
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N,N-Bis(2-chloroethyl)-2,3-dimethoxyaniline
Systematic Name English
A-14494
Code English
Benzenamine, N,N-bis(2-chloroethyl)-2,3-dimethoxy-
Systematic Name English
NSC-18439
Code English
N,N-Bis(2-chloroethyl)-2,3-dimethoxybenzenamine
Systematic Name English
2,3-Dimethoxyaniline mustard
Common Name English
Aniline, N,N-bis(2-chloroethyl)-2,3-dimethoxy-
Systematic Name English
Code System Code Type Description
FDA UNII
KBX8M395BE
Created by admin on Sat Dec 16 13:11:56 GMT 2023 , Edited by admin on Sat Dec 16 13:11:56 GMT 2023
PRIMARY
PUBCHEM
20192
Created by admin on Sat Dec 16 13:11:56 GMT 2023 , Edited by admin on Sat Dec 16 13:11:56 GMT 2023
PRIMARY
NSC
18439
Created by admin on Sat Dec 16 13:11:56 GMT 2023 , Edited by admin on Sat Dec 16 13:11:56 GMT 2023
PRIMARY
EPA CompTox
DTXSID90194967
Created by admin on Sat Dec 16 13:11:56 GMT 2023 , Edited by admin on Sat Dec 16 13:11:56 GMT 2023
PRIMARY
CAS
4213-41-6
Created by admin on Sat Dec 16 13:11:56 GMT 2023 , Edited by admin on Sat Dec 16 13:11:56 GMT 2023
PRIMARY