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Home > Nitro Compounds > 81115-43-7

81115-43-7

81115-43-7 | 6-Methyl-5-nitro-1H-indazole

CAS No: 81115-43-7 Catalog No: AG0038F6 MDL No:MFCD03305368

Product Description

Catalog Number:
AG0038F6
Chemical Name:
6-Methyl-5-nitro-1H-indazole
CAS Number:
81115-43-7
Molecular Formula:
C8H7N3O2
Molecular Weight:
177.1601
MDL Number:
MFCD03305368
IUPAC Name:
6-methyl-5-nitro-1H-indazole
InChI:
InChI=1S/C8H7N3O2/c1-5-2-7-6(4-9-10-7)3-8(5)11(12)13/h2-4H,1H3,(H,9,10)
InChI Key:
JNIDNZRLKGLAOP-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc2cn[nH]c2cc1C

Properties

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

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