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Methylphosphonic acid

CAS No.:
993-13-5
Catalog Number:
AG00359J
Molecular Formula:
CH5O3P
Molecular Weight:
96.0224
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Purity
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Product Description
Catalog Number:
AG00359J
Chemical Name:
Methylphosphonic acid
CAS Number:
993-13-5
Molecular Formula:
CH5O3P
Molecular Weight:
96.0224
MDL Number:
MFCD00002137
IUPAC Name:
methylphosphonic acid
InChI:
InChI=1S/CH5O3P/c1-5(2,3)4/h1H3,(H2,2,3,4)
InChI Key:
YACKEPLHDIMKIO-UHFFFAOYSA-N
SMILES:
CP(=O)(O)O
EC Number:
213-607-2
UNII:
329W4YM10Z
NSC Number:
119358
Properties
Complexity:
61.3  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
95.998g/mol
Formal Charge:
0
Heavy Atom Count:
5  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
96.022g/mol
Monoisotopic Mass:
95.998g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.6  
Literature
Title Journal
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153Sm and 166Ho complexes with tetraaza macrocycles containing pyridine and methylcarboxylate or methylphosphonate pendant arms. Journal of biological inorganic chemistry : JBIC : a publication of the Society of Biological Inorganic Chemistry 20041001
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Remote phosphate contacts trigger assembly of the active site of DNA topoisomerase IB. Structure (London, England : 1993) 20040101
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The chemical and biochemical properties of methylphosphotriester DNA. Nucleosides, nucleotides & nucleic acids 20040101
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A comparison of phosphonothioic acids with phosphonic acids as phosphatase inhibitors. Journal of medicinal chemistry 20030814
Synthesis, characterization and antitumor activity of platinum(II) complexes with diethyl and monoethyl 2-quinolylmethylphosphonates. Journal of inorganic biochemistry 20030701
Guarding the genome: electrostatic repulsion of water by DNA suppresses a potent nuclease activity of topoisomerase IB. Molecular cell 20030701
Inhibition of HIV tat-TAR interactions by an antisense oligo-2'-O-methylribonucleoside methylphosphonate. Bioorganic & medicinal chemistry letters 20030602
Modeling of flap endonuclease interactions with DNA substrate. Journal of molecular biology 20030502
Hydrogen bonding in 1-carbamoylguanidinium methylphosphonate monohydrate. Acta crystallographica. Section C, Crystal structure communications 20030501
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In vivo behavior of copper-64-labeled methanephosphonate tetraaza macrocyclic ligands. Journal of biological inorganic chemistry : JBIC : a publication of the Society of Biological Inorganic Chemistry 20030101
Measurements of chemical warfare agent degradation products using an electrophoresis microchip with contactless conductivity detector. Analytical chemistry 20021201
Improved tert-butyldimethylsilylation gas chromatographic/mass spectrometric detection of nerve gas hydrolysis products from soils by pretreatment of aqueous alkaline extraction and strong anion-exchange solid-phase extraction. Analytical chemistry 20020915
Importance of phosphate contacts for sequence recognition by EcoRI restriction enzyme. Biochemical and biophysical research communications 20020705
Bending of DNA by asymmetric charge neutralization: all-atom energy simulations. Journal of the American Chemical Society 20020501
Structure solution of a novel aluminium methylphosphonate using a new simulated annealing program and powder X-ray diffraction data. Chemical communications (Cambridge, England) 20020421
Selective stationary phase for solid-phase microextraction analysis of sarin (GB). Journal of chromatography. A 20020419
Molecular modeling of protein tyrosine phosphatase 1B (PTP 1B) inhibitors. Bioorganic & medicinal chemistry 20020401
Generation and characterization of ionic and neutral P(OH)2+/* in the gas phase by tandem mass spectrometry and computational chemistry. Journal of the American Society for Mass Spectrometry 20020301
Structure of hybrid backbone methylphosphonate DNA heteroduplexes: effect of R and S stereochemistry. Biochemistry 20020122
Synthesis of enzymatically and chemically non-hydrolyzable analogues of dinucleoside triphosphates Ap(3)A and Gp(3)G. The Journal of organic chemistry 20020111
P-chiral oligonucleotides. 2D Roesy NMR assignment of absolute configuration at phosphorus and conformational analysis of 5'-O-monomethoxytrityl-(2'-O-deoxyribonucleoside) 3'-O-[O-(4-nitrophenyl)]methanephosphonates. Nucleosides, nucleotides & nucleic acids 20020101
Labelled oligonucleotides as radiopharmaceuticals: pitfalls, problems and perspectives. Current pharmaceutical design 20020101
Analysis of the degradation compounds of chemical warfare agents using liquid chromatography/mass spectrometry. Journal of applied toxicology : JAT 20011201
Charge migration in DNA: ion-gated transport. Science (New York, N.Y.) 20011019
Contacts between the 5' nuclease of DNA polymerase I and its DNA substrate. The Journal of biological chemistry 20010810
Backbone modification of nucleic acids: synthesis, structure and therapeutic applications. Current medicinal chemistry 20010801
DNA repair excision nuclease attacks undamaged DNA. A potential source of spontaneous mutations. The Journal of biological chemistry 20010706
High-sensitivity determination of the degradation products of chemical warfare agents by capillary electrophoresis-indirect UV absorbance detection. Journal of chromatography. A 20010622
Neurophysiologic effects of chemical agent hydrolysis products on cortical neurons in vitro. Neurotoxicology 20010601
Fragmentation mechanisms of oligodeoxynucleotides: effects of replacing phosphates with methylphosphonates and thymines with other bases in T-rich sequences. Journal of the American Society for Mass Spectrometry 20010501
Effect of pedological characteristics on aqueous soil extraction recovery and tert-butyldimethylsilylation yield for gas chromatography-mass spectrometry of nerve gas hydrolysis products from soils. Environmental science & technology 20010501
Indirect laser-induced fluorescence detection for capillary electrophoresis using a violet diode laser. Analytical chemistry 20010415
Evaluation of methylphosphonates as analogs for detecting phosphate contacts in RNA-protein complexes. RNA (New York, N.Y.) 20010401
Inactivation of human O(6)-alkylguanine-DNA alkyltransferase by modified oligodeoxyribonucleotides containing O(6)-benzylguanine. The Journal of pharmacology and experimental therapeutics 20010301
Natural and azido fatty acids inhibit phosphate transport and activate fatty acid anion uniport mediated by the mitochondrial phosphate carrier. The Journal of biological chemistry 20010216
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Properties