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Home > Nitro Compounds > 145162-69-2
145162-69-2 | 1H-Pyrazole, 5-nitro-1-(phenylmethyl)-
CAS No: 145162-69-2 Catalog No: AG00HXED MDL No:
Product Description
Catalog Number:
AG00HXED
Chemical Name:
1H-Pyrazole, 5-nitro-1-(phenylmethyl)-
CAS Number:
145162-69-2
IUPAC Name:
1-benzyl-5-nitropyrazole
InChI:
InChI=1S/C10H9N3O2/c14-13(15)10-6-7-11-12(10)8-9-4-2-1-3-5-9/h1-7H,8H2
InChI Key:
RJFGWYJJOPSQAF-UHFFFAOYSA-N
Properties
Complexity:
223
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.069g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
203.201g/mol
Monoisotopic Mass:
203.069g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2
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