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Details

Stereochemistry ACHIRAL
Molecular Formula C21H13O6P
Molecular Weight 392.2981
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(3,3'-DIOXO-1,1'-SPIROBI(2,1-BENZOXAPHOSPHOL)-1(3'H,3H)-YL)BENZOIC ACID

SMILES

OC(=O)C1=C(C=CC=C1)P234OC(=O)C5=C2C=CC=C5.O=C(O3)C6=C4C=CC=C6

InChI

InChIKey=KGCDZMDTGSWODN-UHFFFAOYSA-N
InChI=1S/C21H13O6P/c22-19(23)13-7-1-4-10-16(13)28(17-11-5-2-8-14(17)20(24)26-28)18-12-6-3-9-15(18)21(25)27-28/h1-12H,(H,22,23)

HIDE SMILES / InChI

Molecular Formula C21H13O6P
Molecular Weight 392.2981
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 Sat Dec 16 12:41:07 GMT 2023
Edited
by admin
on Sat Dec 16 12:41:07 GMT 2023
Record UNII
ZES7J9BUU3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-(3,3'-DIOXO-1,1'-SPIROBI(2,1-BENZOXAPHOSPHOL)-1(3'H,3H)-YL)BENZOIC ACID
Systematic Name English
NSC-299862
Code English
BENZOIC ACID, 2-(3,3'-DIOXO-1,1'-SPIROBI(2,1-BENZOXAPHOSPHOL)-1(3'H,3H)-YL)-
Systematic Name English
Code System Code Type Description
NSC
299862
Created by admin on Sat Dec 16 12:41:07 GMT 2023 , Edited by admin on Sat Dec 16 12:41:07 GMT 2023
PRIMARY
EPA CompTox
DTXSID10205943
Created by admin on Sat Dec 16 12:41:07 GMT 2023 , Edited by admin on Sat Dec 16 12:41:07 GMT 2023
PRIMARY
PUBCHEM
326945
Created by admin on Sat Dec 16 12:41:07 GMT 2023 , Edited by admin on Sat Dec 16 12:41:07 GMT 2023
PRIMARY
FDA UNII
ZES7J9BUU3
Created by admin on Sat Dec 16 12:41:07 GMT 2023 , Edited by admin on Sat Dec 16 12:41:07 GMT 2023
PRIMARY
CAS
57322-20-0
Created by admin on Sat Dec 16 12:41:07 GMT 2023 , Edited by admin on Sat Dec 16 12:41:07 GMT 2023
PRIMARY