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

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

CAS: 282524-93-0

Formula: C21H23NO4

SMILES: CC(C)C(CC(O)=O)NC(=O)OCC1C2=CC=CC=C2C2=CC=CC=C12

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

InChI: InChI=1/C21H23NO4/c1-13(2)19(11-20(23)24)22-21(25)26-12-18-16-9-5-3-7-14(16)15-8-4-6-10-17(15)18/h3-10,13,18-19H,11-12H2,1-2H3,(H,22,25)(H,23,24)

Composition: C (71.37%), H (6.56%), N (3.96%), O (18.11%)

Molar Mass: 353.418

Atom Count: 49

Heavy Atom Count: 26

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 353.162708225
Formal Charge 0
FSP3 0.33
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey KFDMTAMWOIQTOB-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 98.2
Topological Polar Surface Area 75.63
Polarizability 39.52
Ring Count 3
Rotatable Bond Count 7

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Purity LeadTime CAS PacketSize UnitPrice
97% <7 Days 282524-93-0 $155.52-$697.92$155.52$233.28$697.92
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