1-[3-(4-chlorophenyl)-1H-pyrazol-4-yl]methanamine

1-[3-(4-chlorophenyl)-1H-pyrazol-4-yl]methanamine

CAS: 1020052-19-0

Formula: C10H10ClN3

SMILES: NCC1=CNN=C1C1=CC=C(Cl)C=C1

IUPAC: 1-[3-(4-chlorophenyl)-1H-pyrazol-4-yl]methanamine

InChI: InChI=1S/C10H10ClN3/c11-9-3-1-7(2-4-9)10-8(5-12)6-13-14-10/h1-4,6H,5,12H2,(H,13,14)

Composition: C (57.84%), H (4.85%), Cl (17.07%), N (20.24%)

Molar Mass: 207.66

Atom Count: 24

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	207.056325
Formal Charge	0
FSP3	0.1
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	HUZOCOJYLREAJA-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	57.79
Topological Polar Surface Area	54.7
Polarizability	23.32
Ring Count	2
Rotatable Bond Count	2

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