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tert-butyl 4-[(3-fluorophenyl)amino]piperidine-1-carboxylate

tert-butyl 4-[(3-fluorophenyl)amino]piperidine-1-carboxylate

CAS: 679409-18-8

Formula: C16H23FN2O2

SMILES: CC(C)(C)OC(=O)N1CCC(CC1)NC1=CC(F)=CC=C1

IUPAC: tert-butyl 4-[(3-fluorophenyl)amino]piperidine-1-carboxylate

InChI: InChI=1S/C16H23FN2O2/c1-16(2,3)21-15(20)19-9-7-13(8-10-19)18-14-6-4-5-12(17)11-14/h4-6,11,13,18H,7-10H2,1-3H3

Composition: C (65.28%), H (7.88%), F (6.45%), N (9.52%), O (10.87%)

Molar Mass: 294.37

Atom Count: 44

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 294.174356152
Formal Charge 0
FSP3 0.56
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey ZJWJLMVMSWQJEG-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 81.62
Topological Polar Surface Area 41.57
Polarizability 30.73
Ring Count 2
Rotatable Bond Count 4

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Key Organics Ltd
Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 679409-18-8 $51.35-$479.61$51.35$63.37$86.31$121.27$302.62$479.61
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Struchem co.,ltd
Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 679409-18-8 $2,200.00-$3,960.00$2,200.00$3,080.00$3,960.00
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Molecule Market Select
Purity LeadTime CAS PacketSize UnitPrice
97% <5 Days 679409-18-8 $185.37-$799.47$185.37$505.66$799.47
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