DISODIUM AZACYCLOHEPTANE DIPHOSPHONATE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C6H13NO6P2.2Na
Molecular Weight	303.0976
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of DISODIUM AZACYCLOHEPTANE DIPHOSPHONATE

Structure Search

SMILES

[Na+].[Na+].OP([O-])(=O)C1(CCCCCN1)P(O)([O-])=O

InChI

InChIKey=PXBZPVFAAVSLKY-UHFFFAOYSA-L

InChI=1S/C6H15NO6P2.2Na/c8-14(9,10)6(15(11,12)13)4-2-1-3-5-7-6;;/h7H,1-5H2,(H2,8,9,10)(H2,11,12,13);;/q;2*+1/p-2

HIDE SMILES / InChI

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

Molecular Formula	C6H13NO6P2
Molecular Weight	257.118
Charge	-2
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 21:25:48 GMT 2025` Edited by `admin` on `Mon Mar 31 21:25:48 GMT 2025`
Record UNII	1T310X6POE
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

AHP 100

Preferred Name

English

DISODIUM AZACYCLOHEPTANE DIPHOSPHONATE

Official Name

English

PHOSPHONIC ACID, P,P'-(HEXAHYDRO-2H-AZEPIN-2-YLIDENE)BIS-, SODIUM SALT (1:2)

Common Name

English

(HEXAHYDRO-2H-AZEPIN-2-YLIDENE)BISPHOSPHONIC ACID, DISODIUM SALT

Common Name

English

DISODIUM AZACYCLOHEPTANE-2,2-DIPHOSPHONATE

Systematic Name

English

PHOSPHONIC ACID, (HEXAHYDRO-2H-AZEPIN-2-YLIDENE)BIS-, DISODIUM SALT

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID10211746

Created by admin on Mon Mar 31 21:25:48 GMT 2025 , Edited by admin on Mon Mar 31 21:25:48 GMT 2025

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FDA UNII

1T310X6POE

Created by admin on Mon Mar 31 21:25:48 GMT 2025 , Edited by admin on Mon Mar 31 21:25:48 GMT 2025

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CAS

62682-16-0

Created by admin on Mon Mar 31 21:25:48 GMT 2025 , Edited by admin on Mon Mar 31 21:25:48 GMT 2025

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PUBCHEM

14121836

Created by admin on Mon Mar 31 21:25:48 GMT 2025 , Edited by admin on Mon Mar 31 21:25:48 GMT 2025

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