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(2S)-4-cyclohexyl-2-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}butanoic acid

(2S)-4-cyclohexyl-2-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}butanoic acid

CAS: 269078-73-1

Formula: C25H29NO4

SMILES: OC(=O)[C@H](CCC1CCCCC1)NC(=O)OCC1C2=CC=CC=C2C2=C1C=CC=C2

IUPAC: (2S)-4-cyclohexyl-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)butanoic acid

InChI: InChI=1S/C25H29NO4/c27-24(28)23(15-14-17-8-2-1-3-9-17)26-25(29)30-16-22-20-12-6-4-10-18(20)19-11-5-7-13-21(19)22/h4-7,10-13,17,22-23H,1-3,8-9,14-16H2,(H,26,29)(H,27,28)/t23-/m0/s1

Composition: C (73.69%), H (7.17%), N (3.44%), O (15.70%)

Molar Mass: 407.51

Atom Count: 59

Heavy Atom Count: 30

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 407.209658418
Formal Charge 0
FSP3 0.44
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey KYXCSTPOLMVGMS-QHCPKHFHSA-N
Lipinski's Rule of Five
Molar Refractivity 114.85
Topological Polar Surface Area 75.63
Polarizability 46.16
Ring Count 4
Rotatable Bond Count 8

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Purity LeadTime CAS PacketSize UnitPrice
97% <7 Days 269078-73-1 $39.36-$863.04$39.36$190.08$355.20$863.04
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95% <5 Days 269078-73-1 $22.70-$1,103.38$22.70$47.92$235.81$441.35$1,103.38
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