Ethyl methylphosphonate - CAS 1832-53-7

Catalog:	BB014044
Product Name:	Ethyl methylphosphonate
CAS:	1832-53-7
Synonyms:	ethoxy(methyl)phosphinic acid

Technical Data

Safety and Hazards

Patents

Literatures

Computed Properties

IUPAC Name:	ethoxy(methyl)phosphinic acid
Description:	Ethyl methylphosphonate (CAS# 1832-53-7) is a substance used in the analytical determination of nerve agent metabolites in biomedical and human urine samples. It is also used in the detoxification of chemical warfare agents by metal-organic framework CuBTC using NMR spectroscopy.
Molecular Weight:	124.08
Molecular Formula:	C3H9O3P
Canonical SMILES:	CCOP(=O)(C)O
InChI:	InChI=1S/C3H9O3P/c1-3-6-7(2,4)5/h3H2,1-2H3,(H,4,5)
InChI Key:	UFZOPKFMKMAWLU-UHFFFAOYSA-N
Appearance:	Liquid
MDL:	MFCD00192159
LogP:	0.83810
Vapor Pressure:	0.01 [mmHg]

Publication Number	Title	Priority Date
CN-112210117-A	Rat-proof agent with flame-retardant synergistic function and preparation method and application thereof	20201010
CN-112226003-A	Rat-proof cable sheath material for ships and warships and preparation method and application thereof	20201010
CN-112280142-A	Low-smoke halogen-free flame-retardant rat-proof oil-proof polyolefin cable material and preparation method and application thereof	20201010
CN-111909199-A	Resource utilization method for rectification high-boiling residues of diethyl methylphosphonite	20200806
CN-111909199-B	Resource utilization method for rectification high-boiling residues of diethyl methylphosphonite	20200806

PMID	Publication Date	Title	Journal
27387540	20161125	Efficacy of novel phenoxyalkyl pyridinium oximes as brain-penetrating reactivators of cholinesterase inhibited by surrogates of sarin and VX	Chemico-biological interactions
26965078	20160425	Comparison of inhibition kinetics of several organophosphates, including some nerve agent surrogates, using human erythrocyte and rat and mouse brain acetylcholinesterase	Toxicology letters
22673812	20120720	Zirconia coated stir bar sorptive extraction combined with large volume sample stacking capillary electrophoresis-indirect ultraviolet detection for the determination of chemical warfare agent degradation products in water samples	Journal of chromatography. A
22018853	20120410	Dust as a collection media for contaminant source attribution	Forensic science international
22326187	20120316	Determination of S-2-(N,N-diisopropylaminoethyl)- and S-2-(N,N-diethylaminoethyl) methylphosphonothiolate, nerve agent markers, in water samples using strong anion-exchange disk extraction, in vial trimethylsilylation, and gas chromatography-mass spectrometry analysis	Journal of chromatography. A

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Related Functional Groups

Phosphorus Compounds

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3-(Trihydroxysilyl)propyl methylphosphonate, monosodium salt solution
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3-Methoxybenzylphosphonic acid
[757-54-0]
Allylphosphonic acid dimethyl ester
[2404-75-3]
Diethyl n-butanephosphonate
[35051-50-4]
Ethyl 2-(diethoxyphosphoryl)-3-methylbutanoate

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GHS Hazard Statement:	H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P310, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	90.2
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	124.02893114
Formal Charge:	0
Heavy Atom Count:	7
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	124.02893114
Rotatable Bond Count:	2
Topological Polar Surface Area:	46.5
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.7