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Details

Stereochemistry ACHIRAL
Molecular Formula C9H17F2O4P
Molecular Weight 258.1994
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Dimethyl P-(3,3-difluoro-2-oxoheptyl)phosphonate

SMILES

CCCCC(F)(F)C(=O)CP(=O)(OC)OC

InChI

InChIKey=CISDEVRDMKWPCP-UHFFFAOYSA-N
InChI=1S/C9H17F2O4P/c1-4-5-6-9(10,11)8(12)7-16(13,14-2)15-3/h4-7H2,1-3H3

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
Dimethyl P-(3,3-difluoro-2-oxoheptyl)phosphonate
Systematic Name English
(3,3-Difluoro-2-oxoheptyl)phosphonic acid dimethyl ester
Preferred Name English
Phosphonic acid, P-(3,3-difluoro-2-oxoheptyl)-, dimethyl ester
Systematic Name English
Phosphonic acid, (3,3-difluoro-2-oxoheptyl)-, dimethyl ester
Systematic Name English
Dimethyl (2-oxo-3,3-difluoroheptyl)phosphonate
Systematic Name English
1-Dimethoxyphosphoryl-3,3-difluoroheptan-2-one
Systematic Name English
Dimethyl (3,3-difluoro-2-oxoheptyl)phosphonate
Systematic Name English
Code System Code Type Description
FDA UNII
XJ9VWU5KVU
Created by admin on Wed Apr 02 15:54:10 GMT 2025 , Edited by admin on Wed Apr 02 15:54:10 GMT 2025
PRIMARY
CAS
50889-46-8
Created by admin on Wed Apr 02 15:54:10 GMT 2025 , Edited by admin on Wed Apr 02 15:54:10 GMT 2025
PRIMARY
EPA CompTox
DTXSID30455903
Created by admin on Wed Apr 02 15:54:10 GMT 2025 , Edited by admin on Wed Apr 02 15:54:10 GMT 2025
PRIMARY
PUBCHEM
11118722
Created by admin on Wed Apr 02 15:54:10 GMT 2025 , Edited by admin on Wed Apr 02 15:54:10 GMT 2025
PRIMARY
NIH
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