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Home > Nitro Compounds > 885520-77-4
885520-77-4 | 4-methyl-6-nitro-1H-indazole
CAS No: 885520-77-4 Catalog No: AG00IF6T MDL No:MFCD07781465
Product Description
Catalog Number:
AG00IF6T
Chemical Name:
4-methyl-6-nitro-1H-indazole
CAS Number:
885520-77-4
Molecular Formula:
C8H7N3O2
Molecular Weight:
177.1601
MDL Number:
MFCD07781465
IUPAC Name:
4-methyl-6-nitro-1H-indazole
InChI:
InChI=1S/C8H7N3O2/c1-5-2-6(11(12)13)3-8-7(5)4-9-10-8/h2-4H,1H3,(H,9,10)
InChI Key:
LOUROJHPRPDTSO-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(C)c2c(c1)[nH]nc2
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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