3- (Dimethylphosphono) -N-methylolpropionamide

CAT: 0926-FD140297-01Size: 1 gDry Ice: NoHazardous: No

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CAT#:0926-FD140297-01Size:1 g

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CAS Number

20120-33-6

MDL Number

MFCD00468093

Smiles

COP (=O) (CCC (=O) NCO) OC

Molecular Formula

C6H14NO5P

Molecular Weight

211.15 g/mol

Controlled

Chemical Information

Dimethyl N-hydroxymethylcarbamoylethylphosphonate

CAS Number	20120-33-6
PubChem CID	29959
IUPAC Name	3-dimethoxyphosphoryl-N-(hydroxymethyl)propanamide
Molecular Formula	C6H14NO5P
Molecular Weight	211.15
XLogP	-1.9
Topological Polar Surface Area	84.9
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	6
Heavy Atom Count	13
Formal Charge	0
Complexity	199

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)

InChIKey

MCONGYNHPPCHSD-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 20120-33-6

CID: 29959

Formula: C6H14NO5P

MW: 211.15

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	211.15
XLogP3	-1.9
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	6
Exact Mass	211.06095954
Monoisotopic Mass	211.06095954
Topological Polar Surface Area	84.9 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	199
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

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Catalog	Name
423203-01	3- (Dimethylphosphono) -N-methylolpropionamide
TRC-D480798-1G	3-(Dimethylphosphono)-N-methylolpropionamide (~70%)
OR10788	Methyl-4- (dimethylphosphono) crotonate, tech
297193-01	N, N', N'', N''', N'''', N'''''-Hexaacetylchitohexaose
TRC-H290750-10MG	N,N’,N’’,N’’’,N’’’’,N’’’’’-Hexaacetylchitohexaose
OR9122-01	N, N, N', N', N'', N''-Hexamethylmethanetriamine
OR22662	N, N, N, N, N, N-hexaethylphosphinetricarboxamide
AR-O01213-01	N, N’, N’’, N’’’, N’’’’, N’’’’’-Hexaacetylchitohexaose
sc-255378	N, N, N', N'', N''-Pentamethyldiethylenetriamine
TRC-P225000-100MG	N,N’,N’’,N’’’,N’’’’-Pentaacetylchitopentaose