1H-Indazole, 5-methyl-6-nitro-


Chemical Name: 1H-Indazole, 5-methyl-6-nitro-
CAS Number: 72521-00-7
Product Number: AG00FBFE(AGN-PC-0NJPKE)
Synonyms:
MDL No:
Molecular Formula: C8H7N3O2
Molecular Weight: 177.1601

Identification/Properties


Computed Properties
Molecular Weight:
177.163g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
177.054g/mol
Monoisotopic Mass:
177.054g/mol
Topological Polar Surface Area:
74.5A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
216
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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