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(2S)-6-[(tert-butoxycarbonyl)amino]-2-acetamidohexanoic acid

(2S)-6-[(tert-butoxycarbonyl)amino]-2-acetamidohexanoic acid

CAS: 23500-04-1

Formula: C13H24N2O5

SMILES: CC(=O)N[C@@H](CCCCNC(=O)OC(C)(C)C)C(O)=O

IUPAC: (2S)-6-{[(tert-butoxy)carbonyl]amino}-2-acetamidohexanoic acid

InChI: InChI=1S/C13H24N2O5/c1-9(16)15-10(11(17)18)7-5-6-8-14-12(19)20-13(2,3)4/h10H,5-8H2,1-4H3,(H,14,19)(H,15,16)(H,17,18)/t10-/m0/s1

Composition: C (54.15%), H (8.39%), N (9.72%), O (27.74%)

Molar Mass: 288.344

Atom Count: 44

Heavy Atom Count: 20

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 288.168521881
Formal Charge 0
FSP3 0.77
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 3
InChIKey NZAMQYCOJSWUAO-JTQLQIEISA-N
Lipinski's Rule of Five 1
Molar Refractivity 72.13
Topological Polar Surface Area 104.73
Polarizability 28.41
Ring Count 0
Rotatable Bond Count 9

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Purity LeadTime CAS PacketSize UnitPrice
96% <7 Days 23500-04-1 $7.25-$170.78$7.25$12.42$22.77$50.72$170.78
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Purity LeadTime CAS PacketSize UnitPrice
96% <6 Days 23500-04-1 $5.75-$59.80$5.75$13.80$59.80
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