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1-{1-[(2-fluorophenyl)methyl]cyclobutyl}methanamine

1-{1-[(2-fluorophenyl)methyl]cyclobutyl}methanamine

CAS: 1439896-92-0

Formula: C12H16FN

SMILES: NCC1(CC2=CC=CC=C2F)CCC1

IUPAC: 1-{1-[(2-fluorophenyl)methyl]cyclobutyl}methanamine

InChI: InChI=1S/C12H16FN/c13-11-5-2-1-4-10(11)8-12(9-14)6-3-7-12/h1-2,4-5H,3,6-9,14H2

Composition: C (74.58%), H (8.35%), F (9.83%), N (7.25%)

Molar Mass: 193.265

Atom Count: 30

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 193.126677682
Formal Charge 0
FSP3 0.5
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey BKSVKACCAUNCSF-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 55.77
Topological Polar Surface Area 26.02
Polarizability 21.75
Ring Count 2
Rotatable Bond Count 3

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90% <2 Days 1439896-92-0 $510.20-$776.77$510.20$510.20$776.77$776.77
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