Text Search
Structure Search

1-[1-(3-fluorophenyl)pyrazol-4-yl]methanamine hydrochloride

1-[1-(3-fluorophenyl)pyrazol-4-yl]methanamine hydrochloride

CAS: 1390655-01-2

Formula: C10H11ClFN3

SMILES: Cl.NCC1=CN(N=C1)C1=CC=CC(F)=C1

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

InChI: InChI=1S/C10H10FN3.ClH/c11-9-2-1-3-10(4-9)14-7-8(5-12)6-13-14;/h1-4,6-7H,5,12H2;1H

Composition: C (52.76%), H (4.87%), Cl (15.57%), F (8.34%), N (18.46%)

Molar Mass: 227.67

Atom Count: 26

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 227.0625532
Formal Charge 0
FSP3 0.1
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey XFKCONJKPIJIOV-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 53.11
Topological Polar Surface Area 43.84
Polarizability 20.41
Ring Count 2
Rotatable Bond Count 2

Suppliers

No suppliers are currently stocking this item.