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Details

Stereochemistry ACHIRAL
Molecular Formula C8H5O4.Na
Molecular Weight 188.1127
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SODIUM BIPHTHALATE

SMILES

[Na+].OC(=O)C1=C(C=CC=C1)C([O-])=O

InChI

InChIKey=IZUPJOYPPLEPGM-UHFFFAOYSA-M
InChI=1S/C8H6O4.Na/c9-7(10)5-3-1-2-4-6(5)8(11)12;/h1-4H,(H,9,10)(H,11,12);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula C8H5O4
Molecular Weight 165.1229
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

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

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 19:38:53 UTC 2023
Edited
by admin
on Fri Dec 15 19:38:53 UTC 2023
Record UNII
0341010SIJ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SODIUM BIPHTHALATE
Common Name English
MONOSODIUM PHTHALATE
Systematic Name English
1,2-BENZENEDICARBOXYLIC ACID, SODIUM SALT (1:1)
Common Name English
SODIUM HYDROGEN PHTHALATE
Systematic Name English
Code System Code Type Description
PUBCHEM
22184351
Created by admin on Fri Dec 15 19:38:53 UTC 2023 , Edited by admin on Fri Dec 15 19:38:53 UTC 2023
PRIMARY
EPA CompTox
DTXSID8061185
Created by admin on Fri Dec 15 19:38:53 UTC 2023 , Edited by admin on Fri Dec 15 19:38:53 UTC 2023
PRIMARY
CAS
827-27-0
Created by admin on Fri Dec 15 19:38:53 UTC 2023 , Edited by admin on Fri Dec 15 19:38:53 UTC 2023
PRIMARY
FDA UNII
0341010SIJ
Created by admin on Fri Dec 15 19:38:53 UTC 2023 , Edited by admin on Fri Dec 15 19:38:53 UTC 2023
PRIMARY
ECHA (EC/EINECS)
212-568-9
Created by admin on Fri Dec 15 19:38:53 UTC 2023 , Edited by admin on Fri Dec 15 19:38:53 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE