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Details

Stereochemistry ACHIRAL
Molecular Formula C12H8N3O5.Na
Molecular Weight 297.1988
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of sodium,4-(2,4-dinitroanilino)phenolate

SMILES

[Na+].[O-]C1=CC=C(NC2=CC=C(C=C2[N+]([O-])=O)[N+]([O-])=O)C=C1

InChI

InChIKey=DLZDTVDZZJSFLY-UHFFFAOYSA-M
InChI=1S/C12H9N3O5.Na/c16-10-4-1-8(2-5-10)13-11-6-3-9(14(17)18)7-12(11)15(19)20;/h1-7,13,16H;/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula C12H8N3O5
Molecular Weight 274.209
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 Sat Dec 16 19:22:26 GMT 2023
Edited
by admin
on Sat Dec 16 19:22:26 GMT 2023
Record UNII
H76UAF5A7Z
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
sodium,4-(2,4-dinitroanilino)phenolate
Common Name English
Phenol, 4-[(2,4-dinitrophenyl)amino]-, monosodium salt
Common Name English
Phenol, 4-[(2,4-dinitrophenyl)amino]-, sodium salt (1:1)
Common Name English
Code System Code Type Description
PUBCHEM
44150710
Created by admin on Sat Dec 16 19:22:27 GMT 2023 , Edited by admin on Sat Dec 16 19:22:27 GMT 2023
PRIMARY
FDA UNII
H76UAF5A7Z
Created by admin on Sat Dec 16 19:22:27 GMT 2023 , Edited by admin on Sat Dec 16 19:22:27 GMT 2023
PRIMARY
EPA CompTox
DTXSID20992857
Created by admin on Sat Dec 16 19:22:27 GMT 2023 , Edited by admin on Sat Dec 16 19:22:27 GMT 2023
PRIMARY
CAS
72138-92-2
Created by admin on Sat Dec 16 19:22:27 GMT 2023 , Edited by admin on Sat Dec 16 19:22:27 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE