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

Details

Stereochemistry ACHIRAL
Molecular Formula C5H12ClO3P
Molecular Weight 186.574
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Diethyl (chloromethyl)phosphonate

SMILES

CCOP(=O)(CCl)OCC

InChI

InChIKey=MZBIWKMCTWJLPT-UHFFFAOYSA-N
InChI=1S/C5H12ClO3P/c1-3-8-10(7,5-6)9-4-2/h3-5H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C5H12ClO3P
Molecular Weight 186.574
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 12:13:11 GMT 2023
Edited
by admin
on Sat Dec 16 12:13:11 GMT 2023
Record UNII
H3LYK2K3U6
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Diethyl (chloromethyl)phosphonate
Systematic Name English
Phosphonic acid, P-(chloromethyl)-, diethyl ester
Systematic Name English
NSC-67753
Code English
Diethyl chloromethanephosphonate
Systematic Name English
Phosphonic acid, (chloromethyl)-, diethyl ester
Systematic Name English
AI3-51203
Code English
Code System Code Type Description
CAS
3167-63-3
Created by admin on Sat Dec 16 12:13:11 GMT 2023 , Edited by admin on Sat Dec 16 12:13:11 GMT 2023
PRIMARY
NSC
67753
Created by admin on Sat Dec 16 12:13:11 GMT 2023 , Edited by admin on Sat Dec 16 12:13:11 GMT 2023
PRIMARY
ECHA (EC/EINECS)
221-632-5
Created by admin on Sat Dec 16 12:13:11 GMT 2023 , Edited by admin on Sat Dec 16 12:13:11 GMT 2023
PRIMARY
FDA UNII
H3LYK2K3U6
Created by admin on Sat Dec 16 12:13:11 GMT 2023 , Edited by admin on Sat Dec 16 12:13:11 GMT 2023
PRIMARY
EPA CompTox
DTXSID1062883
Created by admin on Sat Dec 16 12:13:11 GMT 2023 , Edited by admin on Sat Dec 16 12:13:11 GMT 2023
PRIMARY
PUBCHEM
76633
Created by admin on Sat Dec 16 12:13:11 GMT 2023 , Edited by admin on Sat Dec 16 12:13:11 GMT 2023
PRIMARY