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(2S,4R)-1-[(9H-fluoren-9-ylmethoxy)carbonyl]-4-phenoxypyrrolidine-2-carboxylic acid

(2S,4R)-1-[(9H-fluoren-9-ylmethoxy)carbonyl]-4-phenoxypyrrolidine-2-carboxylic acid

CAS: 1313390-76-9

Formula: C26H23NO5

SMILES: OC(=O)[C@@H]1C[C@H](CN1C(=O)OCC1C2=CC=CC=C2C2=CC=CC=C12)OC1=CC=CC=C1

IUPAC: (2S,4R)-1-{[(9H-fluoren-9-yl)methoxy]carbonyl}-4-phenoxypyrrolidine-2-carboxylic acid

InChI: InChI=1S/C26H23NO5/c28-25(29)24-14-18(32-17-8-2-1-3-9-17)15-27(24)26(30)31-16-23-21-12-6-4-10-19(21)20-11-5-7-13-22(20)23/h1-13,18,23-24H,14-16H2,(H,28,29)/t18-,24+/m1/s1

Composition: C (72.71%), H (5.40%), N (3.26%), O (18.63%)

Molar Mass: 429.472

Atom Count: 55

Heavy Atom Count: 32

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 2
Exact Mass 429.157622845
Formal Charge 0
FSP3 0.23
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey DGFDLAYDYAXDTJ-KOSHJBKYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 117.84
Topological Polar Surface Area 76.07
Polarizability 47.22
Ring Count 5
Rotatable Bond Count 6

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97% <7 Days 1313390-76-9 $207.36-$482.88$207.36$318.72$482.88
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