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4-chloro-2-methyl-6-(pyrazol-1-yl)pyrimidine

4-chloro-2-methyl-6-(pyrazol-1-yl)pyrimidine

CAS: 957035-38-0

Formula: C8H7ClN4

SMILES: CC1=NC(=CC(Cl)=N1)N1C=CC=N1

IUPAC: 4-chloro-2-methyl-6-(1H-pyrazol-1-yl)pyrimidine

InChI: InChI=1S/C8H7ClN4/c1-6-11-7(9)5-8(12-6)13-4-2-3-10-13/h2-5H,1H3

Composition: C (49.37%), H (3.63%), Cl (18.21%), N (28.79%)

Molar Mass: 194.62

Atom Count: 20

Heavy Atom Count: 13

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 194.0359239
Formal Charge 0
FSP3 0.12
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey CVEVLWOIJHYNBQ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 51.89
Topological Polar Surface Area 43.6
Polarizability 18.69
Ring Count 2
Rotatable Bond Count 1

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