1-(3-chloro-2-fluorophenyl)methanamine

1-(3-chloro-2-fluorophenyl)methanamine

CAS: 72235-55-3

Formula: C7H7ClFN

SMILES: NCC1=C(F)C(Cl)=CC=C1

IUPAC: 1-(3-chloro-2-fluorophenyl)methanamine

InChI: InChI=1S/C7H7ClFN/c8-6-3-1-2-5(4-10)7(6)9/h1-3H,4,10H2

Composition: C (52.68%), H (4.42%), Cl (22.21%), F (11.90%), N (8.78%)

Molar Mass: 159.59

Atom Count: 17

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	159.0251051
Formal Charge	0
FSP3	0.14
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
InChIKey	LYKWZKBLNOCJMA-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	39.55
Topological Polar Surface Area	26.02
Polarizability	15.27
Ring Count	1
Rotatable Bond Count	1

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