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Details

Stereochemistry ACHIRAL
Molecular Formula C9H23NO6P2
Molecular Weight 303.2295
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ((Heptylimino)bis(methylene))bisphosphonic acid

SMILES

CCCCCCCN(CP(O)(O)=O)CP(O)(O)=O

InChI

InChIKey=GIFYDPWFQBDXKA-UHFFFAOYSA-N
InChI=1S/C9H23NO6P2/c1-2-3-4-5-6-7-10(8-17(11,12)13)9-18(14,15)16/h2-9H2,1H3,(H2,11,12,13)(H2,14,15,16)

HIDE SMILES / InChI

Molecular Formula C9H23NO6P2
Molecular Weight 303.2295
Charge 0
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 19:18:29 GMT 2025
Edited
by admin
on Tue Apr 01 19:18:29 GMT 2025
Record UNII
5G79JS39ZN
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Phosphonic acid, [(heptylimino)bis(methylene)]bis-
Preferred Name English
((Heptylimino)bis(methylene))bisphosphonic acid
Systematic Name English
Code System Code Type Description
PUBCHEM
80097
Created by admin on Tue Apr 01 19:18:29 GMT 2025 , Edited by admin on Tue Apr 01 19:18:29 GMT 2025
PRIMARY
CAS
5995-30-2
Created by admin on Tue Apr 01 19:18:29 GMT 2025 , Edited by admin on Tue Apr 01 19:18:29 GMT 2025
PRIMARY
ECHA (EC/EINECS)
227-829-2
Created by admin on Tue Apr 01 19:18:29 GMT 2025 , Edited by admin on Tue Apr 01 19:18:29 GMT 2025
PRIMARY
FDA UNII
5G79JS39ZN
Created by admin on Tue Apr 01 19:18:29 GMT 2025 , Edited by admin on Tue Apr 01 19:18:29 GMT 2025
PRIMARY
EPA CompTox
DTXSID50208655
Created by admin on Tue Apr 01 19:18:29 GMT 2025 , Edited by admin on Tue Apr 01 19:18:29 GMT 2025
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT