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82892-95-3 | Pyrimidine, 4-(1H-pyrazol-1-yl)-
CAS No: 82892-95-3 Catalog No: AG004RWW MDL No:
Product Description
Catalog Number:
AG004RWW
Chemical Name:
Pyrimidine, 4-(1H-pyrazol-1-yl)-
CAS Number:
82892-95-3
Molecular Formula:
C7H6N4
Molecular Weight:
146.1493
IUPAC Name:
4-pyrazol-1-ylpyrimidine
InChI:
InChI=1S/C7H6N4/c1-3-10-11(5-1)7-2-4-8-6-9-7/h1-6H
InChI Key:
KDWFNBXZXPESTD-UHFFFAOYSA-N
SMILES:
n1ccc(nc1)n1cccn1
Properties
Complexity:
128
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
146.059g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
146.153g/mol
Monoisotopic Mass:
146.059g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
43.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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