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Details

Stereochemistry ACHIRAL
Molecular Formula C9H12N2O6P2
Molecular Weight 306.1489
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of [2-(Benzoimidazol-1-yl)ethylidene]bisphosphonic acid

SMILES

OP(O)(=O)C(CN1C=NC2=C1C=CC=C2)P(O)(O)=O

InChI

InChIKey=ISSICOMKRRPVPD-UHFFFAOYSA-N
InChI=1S/C9H12N2O6P2/c12-18(13,14)9(19(15,16)17)5-11-6-10-7-3-1-2-4-8(7)11/h1-4,6,9H,5H2,(H2,12,13,14)(H2,15,16,17)

HIDE SMILES / InChI

Molecular Formula C9H12N2O6P2
Molecular Weight 306.1489
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 Wed Apr 02 07:12:09 GMT 2025
Edited
by admin
on Wed Apr 02 07:12:09 GMT 2025
Record UNII
Y8AP3Z4SNQ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
[2-(Benzoimidazol-1-yl)ethylidene]bisphosphonic acid
Systematic Name English
P,P?-[2-(1H-Benzimidazol-1-yl)ethylidene]bis[phosphonic acid]
Preferred Name English
Phosphonic acid, P,P?-[2-(1H-benzimidazol-1-yl)ethylidene]bis-
Systematic Name English
[2-(Benzoimidazol-1-yl)-1-phosphono-ethyl]phosphonic acid
Systematic Name English
Code System Code Type Description
FDA UNII
Y8AP3Z4SNQ
Created by admin on Wed Apr 02 07:12:09 GMT 2025 , Edited by admin on Wed Apr 02 07:12:09 GMT 2025
PRIMARY
PUBCHEM
5277505
Created by admin on Wed Apr 02 07:12:09 GMT 2025 , Edited by admin on Wed Apr 02 07:12:09 GMT 2025
PRIMARY
CAS
847738-31-2
Created by admin on Wed Apr 02 07:12:09 GMT 2025 , Edited by admin on Wed Apr 02 07:12:09 GMT 2025
PRIMARY