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(2S)-2-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-6-(2,2,2-trifluoroacetamido)hexanoic acid

(2S)-2-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-6-(2,2,2-trifluoroacetamido)hexanoic acid

CAS: 76265-69-5

Formula: C23H23F3N2O5

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

IUPAC: (2S)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-6-(2,2,2-trifluoroacetamido)hexanoic acid

InChI: InChI=1S/C23H23F3N2O5/c24-23(25,26)21(31)27-12-6-5-11-19(20(29)30)28-22(32)33-13-18-16-9-3-1-7-14(16)15-8-2-4-10-17(15)18/h1-4,7-10,18-19H,5-6,11-13H2,(H,27,31)(H,28,32)(H,29,30)/t19-/m0/s1

Composition: C (59.48%), H (4.99%), F (12.27%), N (6.03%), O (17.22%)

Molar Mass: 464.441

Atom Count: 56

Heavy Atom Count: 33

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 1
Exact Mass 464.155906338
Formal Charge 0
FSP3 0.35
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 3
InChIKey ZVLMWTPNDXNXSZ-IBGZPJMESA-N
Lipinski's Rule of Five 1
Molar Refractivity 112.34
Topological Polar Surface Area 104.73
Polarizability 43.68
Ring Count 3
Rotatable Bond Count 11

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AA BLOCKS INC
Purity LeadTime CAS PacketSize UnitPrice
98% <6 Days 76265-69-5 $4.60-$346.15$4.60$6.90$27.60$115.00$346.15
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Purity LeadTime CAS PacketSize UnitPrice
98% <7 Days 76265-69-5 $6.21-$244.26$6.21$7.25$21.74$37.26$83.84$244.26
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Struchem co.,ltd
Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 76265-69-5 $554.00$554.00
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