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

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

Formula: C23H27NO5

SMILES: CC(C)(C)OCC(CNC(=O)OCC1C2=CC=CC=C2C2=CC=CC=C12)C(O)=O

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

InChI: InChI=1/C23H27NO5/c1-23(2,3)29-13-15(21(25)26)12-24-22(27)28-14-20-18-10-6-4-8-16(18)17-9-5-7-11-19(17)20/h4-11,15,20H,12-14H2,1-3H3,(H,24,27)(H,25,26)

Composition: C (69.50%), H (6.85%), N (3.52%), O (20.13%)

Molar Mass: 397.471

Atom Count: 56

Heavy Atom Count: 29

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 397.188922973
Formal Charge 0
FSP3 0.39
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey PGPAKWBBCOPCSF-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 109.69
Topological Polar Surface Area 84.86
Polarizability 43.89
Ring Count 3
Rotatable Bond Count 9

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98% <10 Days C23H27NO5 Quote Only
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