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Details

Stereochemistry ACHIRAL
Molecular Formula C8H6N2O7
Molecular Weight 242.1424
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METHYL 3,5-DINITROSALICYLATE

SMILES

COC(=O)C1=CC(=CC(=C1O)[N+]([O-])=O)[N+]([O-])=O

InChI

InChIKey=UMELTKSLWXJXNZ-UHFFFAOYSA-N
InChI=1S/C8H6N2O7/c1-17-8(12)5-2-4(9(13)14)3-6(7(5)11)10(15)16/h2-3,11H,1H3

HIDE SMILES / InChI

Approval Year

Name Type Language
NSC-203306
Preferred Name English
METHYL 3,5-DINITROSALICYLATE
Systematic Name English
BENZOIC ACID, 2-HYDROXY-3,5-DINITRO-, METHYL ESTER
Common Name English
3,5-DINITROSALICYLIC ACID, METHYL ESTER
Systematic Name English
METHYL 2-HYDROXY-3,5-DINITROBENZOATE
Common Name English
Code System Code Type Description
PUBCHEM
89779
Created by admin on Wed Apr 02 13:36:56 GMT 2025 , Edited by admin on Wed Apr 02 13:36:56 GMT 2025
PRIMARY
ECHA (EC/EINECS)
245-144-7
Created by admin on Wed Apr 02 13:36:56 GMT 2025 , Edited by admin on Wed Apr 02 13:36:56 GMT 2025
PRIMARY
CAS
22633-33-6
Created by admin on Wed Apr 02 13:36:56 GMT 2025 , Edited by admin on Wed Apr 02 13:36:56 GMT 2025
PRIMARY
NSC
203306
Created by admin on Wed Apr 02 13:36:56 GMT 2025 , Edited by admin on Wed Apr 02 13:36:56 GMT 2025
PRIMARY
EPA CompTox
DTXSID6066816
Created by admin on Wed Apr 02 13:36:56 GMT 2025 , Edited by admin on Wed Apr 02 13:36:56 GMT 2025
PRIMARY
FDA UNII
RQ5L227PAH
Created by admin on Wed Apr 02 13:36:56 GMT 2025 , Edited by admin on Wed Apr 02 13:36:56 GMT 2025
PRIMARY