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Details

Stereochemistry ACHIRAL
Molecular Formula C7H4NO4.Na
Molecular Weight 189.1007
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SODIUM 3-NITROBENZOATE

SMILES

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

InChI

InChIKey=MUADFEZFSKAZLT-UHFFFAOYSA-M
InChI=1S/C7H5NO4.Na/c9-7(10)5-2-1-3-6(4-5)8(11)12;/h1-4H,(H,9,10);/q;+1/p-1

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 C7H4NO4
Molecular Weight 166.111
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 Sat Dec 16 09:00:35 UTC 2023
Edited
by admin
on Sat Dec 16 09:00:35 UTC 2023
Record UNII
I1EQ837B3J
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SODIUM 3-NITROBENZOATE
Systematic Name English
BENZOIC ACID, 3-NITRO-, SODIUM SALT (1:1)
Systematic Name English
SODIUM M-NITROBENZOATE
Systematic Name English
BENZOIC ACID, 3-NITRO-, SODIUM SALT
Systematic Name English
BENZOIC ACID, M-NITRO-, SODIUM SALT
Common Name English
Code System Code Type Description
ECHA (EC/EINECS)
212-578-3
Created by admin on Sat Dec 16 09:00:35 UTC 2023 , Edited by admin on Sat Dec 16 09:00:35 UTC 2023
PRIMARY
FDA UNII
I1EQ837B3J
Created by admin on Sat Dec 16 09:00:35 UTC 2023 , Edited by admin on Sat Dec 16 09:00:35 UTC 2023
PRIMARY
CAS
827-95-2
Created by admin on Sat Dec 16 09:00:35 UTC 2023 , Edited by admin on Sat Dec 16 09:00:35 UTC 2023
PRIMARY
PUBCHEM
70014
Created by admin on Sat Dec 16 09:00:35 UTC 2023 , Edited by admin on Sat Dec 16 09:00:35 UTC 2023
PRIMARY
EPA CompTox
DTXSID0044733
Created by admin on Sat Dec 16 09:00:35 UTC 2023 , Edited by admin on Sat Dec 16 09:00:35 UTC 2023
PRIMARY