U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

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

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 22.9898
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 Sat Dec 16 05:00:57 UTC 2023
Edited
by admin
on Sat Dec 16 05:00:57 UTC 2023
Record UNII
1T310X6POE
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DISODIUM AZACYCLOHEPTANE DIPHOSPHONATE
INCI  
INCI  
Official Name English
PHOSPHONIC ACID, P,P'-(HEXAHYDRO-2H-AZEPIN-2-YLIDENE)BIS-, SODIUM SALT (1:2)
Common Name English
DISODIUM AZACYCLOHEPTANE DIPHOSPHONATE [INCI]
Common Name English
AHP 100
Brand 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 Sat Dec 16 05:00:57 UTC 2023 , Edited by admin on Sat Dec 16 05:00:57 UTC 2023
PRIMARY
FDA UNII
1T310X6POE
Created by admin on Sat Dec 16 05:00:57 UTC 2023 , Edited by admin on Sat Dec 16 05:00:57 UTC 2023
PRIMARY
CAS
62682-16-0
Created by admin on Sat Dec 16 05:00:57 UTC 2023 , Edited by admin on Sat Dec 16 05:00:57 UTC 2023
PRIMARY
PUBCHEM
14121836
Created by admin on Sat Dec 16 05:00:57 UTC 2023 , Edited by admin on Sat Dec 16 05:00:57 UTC 2023
PRIMARY