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80772-97-0 | 6-NITROPYRAZOLO[1,5-A]PYRIMIDINE-3-CARBONITRILE
CAS No: 80772-97-0 Catalog No: AG00G9PW MDL No:
Product Description
Catalog Number:
AG00G9PW
Chemical Name:
6-NITROPYRAZOLO[1,5-A]PYRIMIDINE-3-CARBONITRILE
CAS Number:
80772-97-0
IUPAC Name:
6-nitropyrazolo[1,5-a]pyrimidine-3-carbonitrile
InChI:
InChI=1S/C7H3N5O2/c8-1-5-2-10-11-4-6(12(13)14)3-9-7(5)11/h2-4H
InChI Key:
VNLCZQRGTFVAQI-UHFFFAOYSA-N
Properties
Complexity:
292
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.029g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.134g/mol
Monoisotopic Mass:
189.029g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
99.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
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