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3-(Dimethylphosphono)-N-methylolpropionamide

3-(Dimethylphosphono)-N-methylolpropionamide - CAS 20120-33-6

Catalog:	BB015663
Product Name:	3-(Dimethylphosphono)-N-methylolpropionamide
CAS:	20120-33-6
Synonyms:	3-dimethoxyphosphoryl-N-(hydroxymethyl)propanamide; 3-dimethoxyphosphoryl-N-(hydroxymethyl)propanamide

Technical Data

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Computed Properties

IUPAC Name:	3-dimethoxyphosphoryl-N-(hydroxymethyl)propanamide
Description:	3-(Dimethylphosphono)-N-methylolpropionamide (CAS# 20120-33-6) is a phosphorus flame retardant additive.
Molecular Weight:	211.15
Molecular Formula:	C6H14NO5P
Canonical SMILES:	COP(=O)(CCC(=O)NCO)OC
InChI:	InChI=1S/C6H14NO5P/c1-11-13(10,12-2)4-3-6(9)7-5-8/h8H,3-5H2,1-2H3,(H,7,9)
InChI Key:	MCONGYNHPPCHSD-UHFFFAOYSA-N
Boiling Point:	419.2 °C at 760 mmHg
Density:	1.257 g/cm³
Appearance:	Liquid
LogP:	0.31930

Publication Number	Title	Priority Date
CN-113308889-A	Halogen-free flame-retardant polyester-cotton fabric and preparation method thereof	20210616
CN-112796105-A	Production process of pure cotton CP flame-retardant fabric	20201231
CN-112359597-A	Organic/inorganic hybrid film-coated cotton textile and preparation method thereof	20201207
CN-112411184-A	Finishing process of formaldehyde-free flame-retardant wool product	20201102
CN-112442894-A	Preparation method of durable flame-retardant silk product	20201102

PMID	Publication Date	Title	Journal
21315920	20110315	Phosphate additives determination in meat products by 31-phosphorus nuclear magnetic resonance using new internal reference standard: hexamethylphosphoroamide	Talanta
18667554	20080801	Genetic analysis of genes involved in dipeptide metabolism and cytotoxicity in Pseudomonas aeruginosa PAO1	Microbiology (Reading, England)
17918933	20071031	Characterization of the maduropeptin biosynthetic gene cluster from Actinomadura madurae ATCC 39144 supporting a unifying paradigm for enediyne biosynthesis	Journal of the American Chemical Society
15745821	20050315	Carbonic anhydrase inhibitors. Interaction of isozymes I, II, IV, V, and IX with organic phosphates and phosphonates	Bioorganic & medicinal chemistry letters

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GHS Hazard Statement:	H317 (97.22%): May cause an allergic skin reaction [Warning Sensitization, Skin]
Precautionary Statement:	P261, P271, P272, P280, P302+P352, P304+P312, P304+P340, P312, P321, P333+P313, P363, and P501
Signal Word:	Warning

Complexity:	199
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	211.06095954
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	211.06095954
Rotatable Bond Count:	6
Topological Polar Surface Area:	84.9 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-1.9