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Home > Nitro Compounds > 832740-68-8
832740-68-8 | 7-(3-nitrophenyl)pyrazolo[1,5-a]pyrimidine
CAS No: 832740-68-8 Catalog No: AG019DDW MDL No:MFCD05667198
Product Description
Catalog Number:
AG019DDW
Chemical Name:
7-(3-nitrophenyl)pyrazolo[1,5-a]pyrimidine
CAS Number:
832740-68-8
Molecular Formula:
C12H8N4O2
Molecular Weight:
240.2175
MDL Number:
MFCD05667198
IUPAC Name:
7-(3-nitrophenyl)pyrazolo[1,5-a]pyrimidine
InChI:
InChI=1S/C12H8N4O2/c17-16(18)10-3-1-2-9(8-10)11-4-6-13-12-5-7-14-15(11)12/h1-8H
InChI Key:
OBBNCPWRLTWSHC-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cccc(c1)c1ccnc2n1ncc2
Properties
Complexity:
320
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.065g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.222g/mol
Monoisotopic Mass:
240.065g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
76A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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