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5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl chloride

5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl chloride

CAS: 696649-33-9

Formula: C14H7ClF3N3O

SMILES: FC(F)(F)C1=CC(=NC2=CC(=NN12)C(Cl)=O)C1=CC=CC=C1

IUPAC: 5-phenyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carbonyl chloride

InChI: InChI=1S/C14H7ClF3N3O/c15-13(22)10-7-12-19-9(8-4-2-1-3-5-8)6-11(14(16,17)18)21(12)20-10/h1-7H

Composition: C (51.63%), H (2.17%), Cl (10.89%), F (17.50%), N (12.90%), O (4.91%)

Molar Mass: 325.68

Atom Count: 29

Heavy Atom Count: 22

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 325.022974
Formal Charge 0
FSP3 0.07
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey LOEHDIYBRIFXRO-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 85.13
Topological Polar Surface Area 47.26
Polarizability 28.24
Ring Count 3
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
95% <7 Days 696649-33-9 $322.40$322.40
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