Iminodi (methylphosphonic acid)

CAT: 0127-OR1044200-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-OR1044200-01Size:250 mg

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CAS Number

17261-34-6

Purity

97%

Smiles

O=P(O)(O)CNCP(=O)(O)O

Chemical Information

(Azanediylbis(methylene))bis(phosphonic acid)

See also: Phosphonic acid, (iminobis(methylene))bis- (annotation moved to).

CAS Number	17261-34-6
PubChem CID	176915
IUPAC Name	(phosphonomethylamino)methylphosphonic acid
Molecular Formula	C2H9NO6P2
Molecular Weight	205.04
XLogP	-5.9
Topological Polar Surface Area	127
Hydrogen Bond Donor Count	5
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	4
Heavy Atom Count	11
Formal Charge	0
Complexity	181

SMILES

C(NCP(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C2H9NO6P2/c4-10(5,6)1-3-2-11(7,8)9/h3H,1-2H2,(H2,4,5,6)(H2,7,8,9)

InChIKey

ISQSUCKLLKRTBZ-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 17261-34-6

CID: 176915

Formula: C2H9NO6P2

MW: 205.04

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	205.04
XLogP3	-5.9
Hydrogen Bond Donor Count	5
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	4
Exact Mass	204.99051100
Monoisotopic Mass	204.99051100
Topological Polar Surface Area	127 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	181
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

Catalog	Name
OR1012893-01	Diethylenetriaminepentakis (methylphosphonic acid)
OR27849	{2-[amino (imino) methyl]hydrazino} (4-methoxyphenyl) methylphosphinic acid
OR24541	[2- (diaminomethylidene) hydrazino] (4-methylphenyl) methylphosphinic acid
OR27903	[2- (diaminomethylidene) hydrazino] (3,4,5-trimethoxyphenyl) methylphosphinic acid
OR1041709-01	Amino (imino) methanesulfonic acid
OR1076730	N'-iminobis (ethylenenitrilo) -tetraacetic acid
OR1007605-01	2- ((Benzyloxy) imino) acetic acid
OR1071368-01	Acid-apeg6-acid
BIM1576-01	Okadaic acid, free acid
BIF6400-01	Fusidic acid, free acid

Catalog	Name
452267-01	Iminodi (methylphosphonic Acid)
993-13-5	METHYLPHOSPHONIC ACID
CS-ZH-30388	(Phosphonomethylamino) methylphosphonic acid
468127	Triethylenetetraminehexakis (methylphosphonic Acid)
TRC-M326905-5G	p-Methylphosphonic Acid
1832-53-7	ETHYL METHYLPHOSPHONIC ACID
GW7295-50g	Nitrilotri (methylphosphonic acid)
468128	Triethylenetetraminehexakis (methylphosphonic Acid) -d12
TRC-M326907-50MG	P-Methylphosphonic Acid-13C
TRC-D458393-100MG	Difluoro(trimethylsilyl)methylphosphonic Acid