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Details

Stereochemistry ACHIRAL
Molecular Formula C6H3N3O7.C5H7NO
Molecular Weight 326.2191
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3,5-DIMETHYLISOXAZOLE PICRATE

SMILES

CC1=CC(C)=NO1.OC2=C(C=C(C=C2[N+]([O-])=O)[N+]([O-])=O)[N+]([O-])=O

InChI

InChIKey=GLJPEUIAGJJHMU-UHFFFAOYSA-N
InChI=1S/C6H3N3O7.C5H7NO/c10-6-4(8(13)14)1-3(7(11)12)2-5(6)9(15)16;1-4-3-5(2)7-6-4/h1-2,10H;3H,1-2H3

HIDE SMILES / InChI

Molecular Formula C5H7NO
Molecular Weight 97.1152
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C6H3N3O7
Molecular Weight 229.1039
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 00:26:38 GMT 2023
Edited
by admin
on Sat Dec 16 00:26:38 GMT 2023
Record UNII
09SVC960L8
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3,5-DIMETHYLISOXAZOLE PICRATE
Systematic Name English
ISOXAZOLE, 3,5-DIMETHYL-, COMPD. WITH 2,4,6-TRINITROPHENOL (1:1)
Systematic Name English
Code System Code Type Description
FDA UNII
09SVC960L8
Created by admin on Sat Dec 16 00:26:38 GMT 2023 , Edited by admin on Sat Dec 16 00:26:38 GMT 2023
PRIMARY
PUBCHEM
85858633
Created by admin on Sat Dec 16 00:26:38 GMT 2023 , Edited by admin on Sat Dec 16 00:26:38 GMT 2023
PRIMARY
CAS
58779-52-5
Created by admin on Sat Dec 16 00:26:38 GMT 2023 , Edited by admin on Sat Dec 16 00:26:38 GMT 2023
PRIMARY