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2,3,4,5,6-pentafluorophenyl (2R)-2-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}propanoate

2,3,4,5,6-pentafluorophenyl (2R)-2-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}propanoate

CAS: 125043-04-1

Formula: C24H16F5NO4

SMILES: C[C@@H](NC(=O)OCC1C2=CC=CC=C2C2=C1C=CC=C2)C(=O)OC1=C(F)C(F)=C(F)C(F)=C1F

IUPAC: 2,3,4,5,6-pentafluorophenyl (2R)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)propanoate

InChI: InChI=1S/C24H16F5NO4/c1-11(23(31)34-22-20(28)18(26)17(25)19(27)21(22)29)30-24(32)33-10-16-14-8-4-2-6-12(14)13-7-3-5-9-15(13)16/h2-9,11,16H,10H2,1H3,(H,30,32)/t11-/m1/s1

Composition: C (60.38%), H (3.38%), F (19.90%), N (2.93%), O (13.41%)

Molar Mass: 477.387

Atom Count: 50

Heavy Atom Count: 34

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 1
Exact Mass 477.099948814
Formal Charge 0
FSP3 0.17
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey CJXZXBGKOSXBFR-LLVKDONJSA-N
Lipinski's Rule of Five
Molar Refractivity 110.21
Topological Polar Surface Area 64.63
Polarizability 42.4
Ring Count 4
Rotatable Bond Count 7

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