Disodium dihydrogen (((1-methylethyl)imino)bis(methylene))bisphosphonate

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C5H13NO6P2.2Na
Molecular Weight	291.0869
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of Disodium dihydrogen (((1-methylethyl)imino)bis(methylene))bisphosphonate

Structure Search

SMILES

[Na+].[Na+].CC(C)N(CP(O)(O)=O)CP([O-])([O-])=O

InChI

InChIKey=OLVZKKXNNWXAPU-UHFFFAOYSA-L

InChI=1S/C5H15NO6P2.2Na/c1-5(2)6(3-13(7,8)9)4-14(10,11)12;;/h5H,3-4H2,1-2H3,(H2,7,8,9)(H2,10,11,12);;/q;2*+1/p-2

HIDE SMILES / InChI

Molecular Formula	C5H13NO6P2
Molecular Weight	245.1073
Charge	-2
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	Na
Molecular Weight	22.98976928
Charge	1
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 18:48:44 GMT 2025` Edited by `admin` on `Tue Apr 01 18:48:44 GMT 2025`
Record UNII	BA8TJB6KEK
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

Phosphonic acid, [[(1-methylethyl)imino]bis(methylene)]bis-, disodium salt

Preferred Name

English

Disodium dihydrogen (((1-methylethyl)imino)bis(methylene))bisphosphonate

Systematic Name

English

Code System Code Type Description

FDA UNII

BA8TJB6KEK

Created by admin on Tue Apr 01 18:48:44 GMT 2025 , Edited by admin on Tue Apr 01 18:48:44 GMT 2025

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CAS

94199-81-2

Created by admin on Tue Apr 01 18:48:44 GMT 2025 , Edited by admin on Tue Apr 01 18:48:44 GMT 2025

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ECHA (EC/EINECS)

303-456-1

Created by admin on Tue Apr 01 18:48:44 GMT 2025 , Edited by admin on Tue Apr 01 18:48:44 GMT 2025

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EPA CompTox

DTXSID50240954

Created by admin on Tue Apr 01 18:48:44 GMT 2025 , Edited by admin on Tue Apr 01 18:48:44 GMT 2025

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PUBCHEM

44153755

Created by admin on Tue Apr 01 18:48:44 GMT 2025 , Edited by admin on Tue Apr 01 18:48:44 GMT 2025

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