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tert-butyl 4-{[(2-fluorophenyl)methyl]amino}piperidine-1-carboxylate

tert-butyl 4-{[(2-fluorophenyl)methyl]amino}piperidine-1-carboxylate

CAS: 887583-63-3

Formula: C17H25FN2O2

SMILES: CC(C)(C)OC(=O)N1CCC(CC1)NCC1=C(F)C=CC=C1

IUPAC: tert-butyl 4-{[(2-fluorophenyl)methyl]amino}piperidine-1-carboxylate

InChI: InChI=1S/C17H25FN2O2/c1-17(2,3)22-16(21)20-10-8-14(9-11-20)19-12-13-6-4-5-7-15(13)18/h4-7,14,19H,8-12H2,1-3H3

Composition: C (66.21%), H (8.17%), F (6.16%), N (9.08%), O (10.38%)

Molar Mass: 308.397

Atom Count: 47

Heavy Atom Count: 22

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 308.190006216
Formal Charge 0
FSP3 0.59
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey CPUOKJWOKRVDOZ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 84.67
Topological Polar Surface Area 41.57
Polarizability 32.94
Ring Count 2
Rotatable Bond Count 5

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95% <5 Days 887583-63-3 $830.00-$3,960.00$830.00$2,200.00$3,960.00
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