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(2S)-4-(4-ethylphenyl)-2-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}butanoic acid

(2S)-4-(4-ethylphenyl)-2-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}butanoic acid

CAS: 1260593-21-2

Formula: C27H27NO4

SMILES: CCC1=CC=C(CC[C@H](NC(=O)OCC2C3=CC=CC=C3C3=CC=CC=C23)C(O)=O)C=C1

IUPAC: (2S)-4-(4-ethylphenyl)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)butanoic acid

InChI: InChI=1S/C27H27NO4/c1-2-18-11-13-19(14-12-18)15-16-25(26(29)30)28-27(31)32-17-24-22-9-5-3-7-20(22)21-8-4-6-10-23(21)24/h3-14,24-25H,2,15-17H2,1H3,(H,28,31)(H,29,30)/t25-/m0/s1

Composition: C (75.50%), H (6.34%), N (3.26%), O (14.90%)

Molar Mass: 429.516

Atom Count: 59

Heavy Atom Count: 32

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 1
Exact Mass 429.194008353
Formal Charge 0
FSP3 0.26
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey LESMIZSJJOKOFF-VWLOTQADSA-N
Lipinski's Rule of Five
Molar Refractivity 123.44
Topological Polar Surface Area 75.63
Polarizability 49.05
Ring Count 4
Rotatable Bond Count 9

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Acrotein ChemBio Inc.,
Purity LeadTime CAS PacketSize UnitPrice
97% <7 Days 1260593-21-2 $284.16-$723.84$284.16$465.60$723.84
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