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(2S)-3-butoxy-2-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}propanoic acid

(2S)-3-butoxy-2-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}propanoic acid

CAS: 133368-40-8

Formula: C22H25NO5

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

IUPAC: (2S)-3-butoxy-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)propanoic acid

InChI: InChI=1S/C22H25NO5/c1-2-3-12-27-14-20(21(24)25)23-22(26)28-13-19-17-10-6-4-8-15(17)16-9-5-7-11-18(16)19/h4-11,19-20H,2-3,12-14H2,1H3,(H,23,26)(H,24,25)/t20-/m0/s1

Composition: C (68.91%), H (6.57%), N (3.65%), O (20.86%)

Molar Mass: 383.444

Atom Count: 53

Heavy Atom Count: 28

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 383.173272909
Formal Charge 0
FSP3 0.36
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey UWYBFPJWSCJJIZ-FQEVSTJZSA-N
Lipinski's Rule of Five 1
Molar Refractivity 104.75
Topological Polar Surface Area 84.86
Polarizability 42.05
Ring Count 3
Rotatable Bond Count 10

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97% <7 Days 133368-40-8 $155.52-$344.64$155.52$233.28$344.64
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