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(3R,5R)-1-(tert-butoxycarbonyl)-5-fluoropiperidine-3-carboxylic acid

(3R,5R)-1-(tert-butoxycarbonyl)-5-fluoropiperidine-3-carboxylic acid

CAS: 2703745-63-3

Formula: C11H18FNO4

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

IUPAC: (3R,5R)-1-[(tert-butoxy)carbonyl]-5-fluoropiperidine-3-carboxylic acid

InChI: InChI=1S/C11H18FNO4/c1-11(2,3)17-10(16)13-5-7(9(14)15)4-8(12)6-13/h7-8H,4-6H2,1-3H3,(H,14,15)/t7-,8-/m1/s1

Composition: C (53.43%), H (7.34%), F (7.68%), N (5.66%), O (25.88%)

Molar Mass: 247.266

Atom Count: 35

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 2
Exact Mass 247.121986227
Formal Charge 0
FSP3 0.82
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey VMVJWQZJKYIFJE-HTQZYQBOSA-N
Lipinski's Rule of Five 1
Molar Refractivity 57.59
Topological Polar Surface Area 66.84
Polarizability 22.57
Ring Count 1
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
98% <2 Days 2703745-63-3 $1,587.00-$9,197.70$1,587.00$2,297.70$9,197.70
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