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CAS Number: 40621-84-9
3-methyl-5-nitro-1H-indazole

Structure

 3-methyl-5-nitro-1H-indazole
Name: 3-methyl-5-nitro-1H-indazole
Synonyms:
General Information
Product Number: 40621849

CAS Registry Number 40621-84-9
Name:
1H-?Indazole, 3-?methyl-?5-?nitro-
3-Methyl-5-nitro-1H-indazole

 

Chemical Formula: C8H7N3O2
Exact Mass: 177.05
Molecular Weight: 177.16
m/z: 177.05 (100.0%), 178.06 (8.8%), 178.05 (1.1%)

 

InChI:InChI=1S/C8H7N3O2/c1-5-7-4-6(11(12)13)2-3-8(7)10-9-5/h2-4H,1H3,(H,9,10)

InChI Key:ZGDNJFXKELMVLS-UHFFFAOYSA-N

Canonical SMILES:CC1=C2C=C(C=CC2=NN1)[N+](=O)[O-]

 

Thermal Properties Value Condition Note
Melting Point 213 °C   (1)CAS
Melting Point 212-213 °C   (2)CAS
Melting Point See full text   (3)CAS

Specification

98%
References
  1. (1) Borsche, Walther; Justus Liebigs Annalen der Chemie 1941, V546, P293-303 CAPLUS
  2. (2) Savitskaya, N. V.; Zhurnal Obshchei Khimii 1961, V31, P1924-6 CAPLUS
  3. (3) Sureau, Robert; Bulletin de la Societe Chimique de France 1958, P152-7 CAPLUS
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