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

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

CAS: 218926-46-6

Formula: C21H23NO4

SMILES: CCC(CC)(NC(=O)OCC1C2=CC=CC=C2C2=C1C=CC=C2)C(O)=O

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

InChI: InChI=1S/C21H23NO4/c1-3-21(4-2,19(23)24)22-20(25)26-13-18-16-11-7-5-9-14(16)15-10-6-8-12-17(15)18/h5-12,18H,3-4,13H2,1-2H3,(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 0
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 NUABWLRFIOIRJG-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 98.34
Topological Polar Surface Area 75.63
Polarizability 39.52
Ring Count 3
Rotatable Bond Count 7

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97% <7 Days 218926-46-6 $123.84-$620.16$123.84$186.24$620.16
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Purity LeadTime CAS PacketSize UnitPrice
98% <5 Days 218926-46-6 $171.50-$1,424.93$171.50$373.26$1,424.93
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