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(3R)-3-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-3-(4-hydroxyphenyl)propanoic acid

(3R)-3-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-3-(4-hydroxyphenyl)propanoic acid

CAS: 511272-36-9

Formula: C24H21NO5

SMILES: OC(=O)C[C@@H](NC(=O)OCC1C2=CC=CC=C2C2=C1C=CC=C2)C1=CC=C(O)C=C1

IUPAC: (3R)-3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3-(4-hydroxyphenyl)propanoic acid

InChI: InChI=1S/C24H21NO5/c26-16-11-9-15(10-12-16)22(13-23(27)28)25-24(29)30-14-21-19-7-3-1-5-17(19)18-6-2-4-8-20(18)21/h1-12,21-22,26H,13-14H2,(H,25,29)(H,27,28)/t22-/m1/s1

Composition: C (71.45%), H (5.25%), N (3.47%), O (19.83%)

Molar Mass: 403.434

Atom Count: 51

Heavy Atom Count: 30

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 1
Exact Mass 403.14197278
Formal Charge 0
FSP3 0.17
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 3
InChIKey VJELJMCALKYCRN-JOCHJYFZSA-N
Lipinski's Rule of Five 1
Molar Refractivity 111.05
Topological Polar Surface Area 95.86
Polarizability 44.19
Ring Count 4
Rotatable Bond Count 7

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99% <5 Days 511272-36-9 $146.28-$841.09$146.28$249.68$841.09
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