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Dimethyl fluorophosphate

HCID 80052
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Basic informationOverviewNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
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Basic information

CAS
5954-50-7
Standard SMILES
COP(=O)(F)OC
InChIKey
XCTATYNREGBPBO-UHFFFAOYSA-N
Molecular formula
C2H6FO3P
Average molar mass
128.04 g/mol
Monoisotopic mass
128.00385921

Overview

Pf-1 has been reported in Heterostelium filamentosum with data available.

Names & identifiers

Preferred name
Dimethyl fluorophosphate
IUPAC
[fluoro(methoxy)phosphoryl]oxymethane
English name
Fluorophosphonic acid dimethyl ester
Molecular formula
C2H6FO3P
Molecular weight
128.04

Names & synonyms

Dimethyl fluorophosphate5954-50-7RefChem:1083699(fluoro(methoxy)phosphoryl)oxymethanedimethyl phosphorofluoridateFluophosphoric acid, dimethyl esterDimethylfluorfosfatDimethylfluorfosfat [Czech]PF-1T-1035TL 311Phosphorofluoridic acid, dimethyl ester
Show more names
TL-311DimethylphosphorofluoridateFluoridophosphoric acid dimethyl ester
BRN 1702234Fluorophosphonic acid dimethyl esterfluorophosphoric acid dimethyl esterSCHEMBL575653DTXSID50974944

Database identifiers

CAS
5954-50-7
PubChem CID
80052
DTXSID
DTXSID50974944
Nikkaji
J50.447E

Properties

Computed structural properties

XLogP
-0.1
Topological polar surface area
35.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
7
Formal charge
0
Complexity
84.9

Experimental & physicochemical properties

SpringerMaterials Properties31P nuclear magnetic resonance spectrum

Physicochemical properties

Boiling point
144.21 °C · 144.21°C (estimate)
Density
1.232 · 1.232±0.06 g/cm3(Predicted)

Chemistry & industry

Suppliers2 total

湖北广奥生物科技有限公司027-02702759223056 18162699093 · [email protected]
湖北拓邦化工有限公司027-59106185 13986192185 · [email protected]

Related reactions

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Compound notes

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