Ethylphosphonic acid - CAS 6779-09-5

Catalog:	BB033397
Product Name:	Ethylphosphonic acid
CAS:	6779-09-5
Synonyms:	ethylphosphonic acid

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Computed Properties

IUPAC Name:	ethylphosphonic acid
Description:	Ethylphosphonic acid (CAS# 6779-09-5) is a compound which shows the motif for metallophosphatase inhibition. Also used in the inhibition of acid sphingomyelinase through the synthesis of bisphosphonates for application towards antiinflammatory agents.
Molecular Weight:	110.05
Molecular Formula:	C2H7O3P
Canonical SMILES:	CCP(=O)(O)O
InChI:	InChI=1S/C2H7O3P/c1-2-6(3,4)5/h2H2,1H3,(H2,3,4,5)
InChI Key:	GATNOFPXSDHULC-UHFFFAOYSA-N
Boiling Point:	260.5 ℃ at 760 mmHg
Appearance:	White powder
MDL:	MFCD00002141
LogP:	0.18400

Publication Number	Title	Priority Date
JP-2020125684-A	Building material	20200522
CN-111333083-A	Organic hybrid-CLO structure aluminum phosphate molecular sieve and preparation method thereof	20200427
CN-111498866-A	Organic hybrid-C L O structure silicoaluminophosphate molecular sieve and preparation method thereof	20200427
WO-2021208911-A1	Novel medical use of mdm2 inhibitors	20200414
US-2021313228-A1	Selective deposition with sam for fully aligned via	20200401

PMID	Publication Date	Title	Journal
21341651	20110316	Physiological role of phnP-specified phosphoribosyl cyclic phosphodiesterase in catabolism of organophosphonic acids by the carbon-phosphorus lyase pathway	Journal of the American Chemical Society
20222698	20100406	Surface electrochemistry of mesoporous silicas as a key factor in the design of tailored delivery devices	Langmuir : the ACS journal of surfaces and colloids
20300456	20091202	N-alkyl-N-(phosphonoethyl) substituted (meth)acrylamides - new adhesive monomers for self-etching self-priming one part dental adhesive	Beilstein journal of organic chemistry
19839620	20091111	Hydroperoxylation by hydroxyethylphosphonate dioxygenase	Journal of the American Chemical Society
19724118	20090901	Structure of EstA esterase from psychrotrophic Pseudoalteromonas sp. 643A covalently inhibited by monoethylphosphonate	Acta crystallographica. Section F, Structural biology and crystallization communications

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Related Functional Groups

Phosphorus Compounds

[1263034-19-0]
3-Methoxybenzylphosphonic acid
[757-54-0]
Allylphosphonic acid dimethyl ester
[35051-50-4]
Ethyl 2-(diethoxyphosphoryl)-3-methylbutanoate
[1498-42-6]
Ethyl dichlorophosphite
[2511-09-3]
Ethyl phenylphosphinate
[4736-60-1]
Ethyl triphenylphosphonium iodide

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GHS Hazard Statement:	H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]
Precautionary Statement:	P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501
Signal Word:	Danger

Complexity:	72.9
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	110.01328108
Formal Charge:	0
Heavy Atom Count:	6
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	110.01328108
Rotatable Bond Count:	1
Topological Polar Surface Area:	57.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-1.2