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Details

Stereochemistry ACHIRAL
Molecular Formula C7H5N3O6
Molecular Weight 227.1311
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-AMINO-2,6-DINITROBENZOIC ACID

SMILES

NC1=CC(=C(C(O)=O)C(=C1)[N+]([O-])=O)[N+]([O-])=O

InChI

InChIKey=HRBPUPBLMZFYBP-UHFFFAOYSA-N
InChI=1S/C7H5N3O6/c8-3-1-4(9(13)14)6(7(11)12)5(2-3)10(15)16/h1-2H,8H2,(H,11,12)

HIDE SMILES / InChI

Molecular Formula C7H5N3O6
Molecular Weight 227.1311
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 08:06:57 GMT 2023
Edited
by admin
on Sat Dec 16 08:06:57 GMT 2023
Record UNII
O22WEX3KL7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-AMINO-2,6-DINITROBENZOIC ACID
Systematic Name English
BENZOIC ACID, 4-AMINO-2,6-DINITRO-
Common Name English
Code System Code Type Description
PUBCHEM
2762524
Created by admin on Sat Dec 16 08:06:57 GMT 2023 , Edited by admin on Sat Dec 16 08:06:57 GMT 2023
PRIMARY
CAS
114168-48-8
Created by admin on Sat Dec 16 08:06:57 GMT 2023 , Edited by admin on Sat Dec 16 08:06:57 GMT 2023
PRIMARY
FDA UNII
O22WEX3KL7
Created by admin on Sat Dec 16 08:06:57 GMT 2023 , Edited by admin on Sat Dec 16 08:06:57 GMT 2023
PRIMARY
EPA CompTox
DTXSID70921293
Created by admin on Sat Dec 16 08:06:57 GMT 2023 , Edited by admin on Sat Dec 16 08:06:57 GMT 2023
PRIMARY