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Home > Nitro Compounds > 832739-45-4
832739-45-4 | 2-METHYL-7-(3-NITROPHENYL)PYRAZOLO[1,5-A]PYRIMIDINE
CAS No: 832739-45-4 Catalog No: AG01AO06 MDL No:MFCD05667160
Product Description
Catalog Number:
AG01AO06
Chemical Name:
2-METHYL-7-(3-NITROPHENYL)PYRAZOLO[1,5-A]PYRIMIDINE
CAS Number:
832739-45-4
Molecular Formula:
C13H10N4O2
Molecular Weight:
254.2441
MDL Number:
MFCD05667160
IUPAC Name:
2-methyl-7-(3-nitrophenyl)pyrazolo[1,5-a]pyrimidine
InChI:
InChI=1S/C13H10N4O2/c1-9-7-13-14-6-5-12(16(13)15-9)10-3-2-4-11(8-10)17(18)19/h2-8H,1H3
InChI Key:
NWAPSRJCCLGDKQ-UHFFFAOYSA-N
SMILES:
Cc1cc2n(n1)c(ccn2)c1cccc(c1)[N+](=O)[O-]
Properties
Complexity:
346
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
254.08g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
254.249g/mol
Monoisotopic Mass:
254.08g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
76A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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