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

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

CAS: 131570-56-4

Formula: C23H26N2O6

SMILES: CC(C)(C)OC(=O)N[C@H](CNC(=O)OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)C(O)=O

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

InChI: InChI=1S/C23H26N2O6/c1-23(2,3)31-22(29)25-19(20(26)27)12-24-21(28)30-13-18-16-10-6-4-8-14(16)15-9-5-7-11-17(15)18/h4-11,18-19H,12-13H2,1-3H3,(H,24,28)(H,25,29)(H,26,27)/t19-/m1/s1

Composition: C (64.78%), H (6.15%), N (6.57%), O (22.51%)

Molar Mass: 426.469

Atom Count: 57

Heavy Atom Count: 31

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 426.179086565
Formal Charge 0
FSP3 0.35
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 3
InChIKey MVWPBNQGEGBGRF-LJQANCHMSA-N
Lipinski's Rule of Five 1
Molar Refractivity 112.65
Topological Polar Surface Area 113.96
Polarizability 45.12
Ring Count 3
Rotatable Bond Count 9

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Purity LeadTime CAS PacketSize UnitPrice
97% <7 Days 131570-56-4 $7.25-$134.55$7.25$16.56$47.61$55.89$134.55
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Purity LeadTime CAS PacketSize UnitPrice
98% <5 Days 131570-56-4 $305.00-$391.00$305.00$391.00
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