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methyl (2S,4S)-4-{[1,1'-biphenyl]-4-yloxy}pyrrolidine-2-carboxylate

methyl (2S,4S)-4-{[1,1'-biphenyl]-4-yloxy}pyrrolidine-2-carboxylate

CAS: 774223-27-7

Formula: C18H19NO3

SMILES: COC(=O)[C@@H]1C[C@@H](CN1)OC1=CC=C(C=C1)C1=CC=CC=C1

IUPAC: methyl (2S,4S)-4-{[1,1'-biphenyl]-4-yloxy}pyrrolidine-2-carboxylate

InChI: InChI=1S/C18H19NO3/c1-21-18(20)17-11-16(12-19-17)22-15-9-7-14(8-10-15)13-5-3-2-4-6-13/h2-10,16-17,19H,11-12H2,1H3/t16-,17-/m0/s1

Composition: C (72.71%), H (6.44%), N (4.71%), O (16.14%)

Molar Mass: 297.354

Atom Count: 41

Heavy Atom Count: 22

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 2
Exact Mass 297.136493476
Formal Charge 0
FSP3 0.28
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey FFODGGSYXPUWHK-IRXDYDNUSA-N
Lipinski's Rule of Five 1
Molar Refractivity 83.55
Topological Polar Surface Area 47.56
Polarizability 34.58
Ring Count 3
Rotatable Bond Count 5

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Purity LeadTime CAS PacketSize UnitPrice
95% <2 Days 774223-27-7 $219.25$219.25
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