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tert-butyl (5S)-3,3-difluoro-5-hydroxypiperidine-1-carboxylate

tert-butyl (5S)-3,3-difluoro-5-hydroxypiperidine-1-carboxylate

CAS: 2381062-15-1

Formula: C10H17F2NO3

SMILES: CC(C)(C)OC(=O)N1C[C@@H](O)CC(F)(F)C1

IUPAC: tert-butyl (5S)-3,3-difluoro-5-hydroxypiperidine-1-carboxylate

InChI: InChI=1S/C10H17F2NO3/c1-9(2,3)16-8(15)13-5-7(14)4-10(11,12)6-13/h7,14H,4-6H2,1-3H3/t7-/m0/s1

Composition: C (50.63%), H (7.22%), F (16.02%), N (5.90%), O (20.23%)

Molar Mass: 237.247

Atom Count: 33

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 237.117649737
Formal Charge 0
FSP3 0.9
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey NCHCRPISXZGPTH-ZETCQYMHSA-N
Lipinski's Rule of Five 1
Molar Refractivity 52.8
Topological Polar Surface Area 49.77
Polarizability 20.62
Ring Count 1
Rotatable Bond Count 2

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Shanghai AQ BioPharma Co., Ltd.
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Purity LeadTime CAS PacketSize UnitPrice
97% <8 Days 2381062-15-1 $1,214.29-$5,828.57$1,214.29$3,642.86$5,828.57$10,928.57$17,485.71
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J&W PHARMLAB LLC
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Purity LeadTime CAS PacketSize UnitPrice
96% <2 Days 2381062-15-1 $207.00-$5,612.00$207.00$299.00$483.00$851.00$1,587.00$5,612.00
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