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

Details

Stereochemistry ACHIRAL
Molecular Formula C7H15Cl3N.Cl
Molecular Weight 255.013
Optical Activity NONE
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METHYLTRIS(2-CHLOROETHYL)AMMONIUM CHLORIDE

SMILES

[Cl-].C[N+](CCCl)(CCCl)CCCl

InChI

InChIKey=LKPAPWYXKOHLEM-UHFFFAOYSA-M
InChI=1S/C7H15Cl3N.ClH/c1-11(5-2-8,6-3-9)7-4-10;/h2-7H2,1H3;1H/q+1;/p-1

HIDE SMILES / InChI

Molecular Formula C7H15Cl3N
Molecular Weight 219.56
Charge 1
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity NONE

Molecular Formula ClH
Molecular Weight 36.461
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 Tue Apr 01 19:44:02 GMT 2025
Edited
by admin
on Tue Apr 01 19:44:02 GMT 2025
Record UNII
F5Y7LP6BP5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
METHYLTRIS(2-CHLOROETHYL)AMMONIUM CHLORIDE
Systematic Name English
NSC-41581
Preferred Name English
AMMONIUM, METHYLTRIS(2-CHLOROETHYL)-, CHLORIDE
Systematic Name English
Code System Code Type Description
CAS
6310-39-0
Created by admin on Tue Apr 01 19:44:02 GMT 2025 , Edited by admin on Tue Apr 01 19:44:02 GMT 2025
PRIMARY
FDA UNII
F5Y7LP6BP5
Created by admin on Tue Apr 01 19:44:02 GMT 2025 , Edited by admin on Tue Apr 01 19:44:02 GMT 2025
PRIMARY
PUBCHEM
22761
Created by admin on Tue Apr 01 19:44:02 GMT 2025 , Edited by admin on Tue Apr 01 19:44:02 GMT 2025
PRIMARY
NSC
41581
Created by admin on Tue Apr 01 19:44:02 GMT 2025 , Edited by admin on Tue Apr 01 19:44:02 GMT 2025
PRIMARY
EPA CompTox
DTXSID10979051
Created by admin on Tue Apr 01 19:44:02 GMT 2025 , Edited by admin on Tue Apr 01 19:44:02 GMT 2025
PRIMARY