4-(2-chloroethyl)-1H-pyrazole

4-(2-chloroethyl)-1H-pyrazole

CAS: 438475-37-7

Formula: C5H7ClN2

SMILES: ClCCC1=CNN=C1

IUPAC: 4-(2-chloroethyl)-1H-pyrazole

InChI: InChI=1S/C5H7ClN2/c6-2-1-5-3-7-8-4-5/h3-4H,1-2H2,(H,7,8)

Composition: C (45.99%), H (5.40%), Cl (27.15%), N (21.45%)

Molar Mass: 130.58

Atom Count: 15

Heavy Atom Count: 8

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	130.0297759
Formal Charge	0
FSP3	0.4
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	KBGYVEMTQPFYBN-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	34.37
Topological Polar Surface Area	28.68
Polarizability	12.59
Ring Count	1
Rotatable Bond Count	2

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