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

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

CAS: 861452-42-8

Formula: C11H7ClF3N3O

SMILES: FC(F)(F)C1=CC(=NC2=CC(=NN12)C(Cl)=O)C1CC1

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

InChI: InChI=1S/C11H7ClF3N3O/c12-10(19)7-4-9-16-6(5-1-2-5)3-8(11(13,14)15)18(9)17-7/h3-5H,1-2H2

Composition: C (45.62%), H (2.44%), Cl (12.24%), F (19.68%), N (14.51%), O (5.52%)

Molar Mass: 289.64

Atom Count: 26

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	289.022974
Formal Charge	0
FSP3	0.36
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	WZQIFXLAPFZVPC-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	72.36
Topological Polar Surface Area	47.26
Polarizability	22.34
Ring Count	3
Rotatable Bond Count	3

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