1H-Indazole, 5-nitro-1-(phenylmethyl)-


Chemical Name: 1H-Indazole, 5-nitro-1-(phenylmethyl)-
CAS Number: 23856-20-4
Product Number: AG007MX1(AGN-PC-03I7MQ)
Synonyms:
MDL No:
Molecular Formula: C14H11N3O2
Molecular Weight: 253.2560

Identification/Properties


Computed Properties
Molecular Weight:
253.261g/mol
XLogP3:
3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
253.085g/mol
Monoisotopic Mass:
253.085g/mol
Topological Polar Surface Area:
63.6A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
325
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

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NMR Spectrum


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