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(3S)-3-amino-6-[(tert-butoxycarbonyl)amino]hexanoic acid

(3S)-3-amino-6-[(tert-butoxycarbonyl)amino]hexanoic acid

CAS: 1956436-56-8

Formula: C11H22N2O4

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

IUPAC: (3S)-3-amino-6-{[(tert-butoxy)carbonyl]amino}hexanoic acid

InChI: InChI=1S/C11H22N2O4/c1-11(2,3)17-10(16)13-6-4-5-8(12)7-9(14)15/h8H,4-7,12H2,1-3H3,(H,13,16)(H,14,15)/t8-/m0/s1

Composition: C (53.64%), H (9.00%), N (11.37%), O (25.98%)

Molar Mass: 246.307

Atom Count: 39

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 246.157957196
Formal Charge 0
FSP3 0.82
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 3
InChIKey QLDUAIKSZTULGY-QMMMGPOBSA-N
Lipinski's Rule of Five 1
Molar Refractivity 62.71
Topological Polar Surface Area 101.65
Polarizability 25
Ring Count 0
Rotatable Bond Count 8

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Purity LeadTime CAS PacketSize UnitPrice
95% 1 Day 1956436-56-8 $176.08-$410.87$176.08$234.78$410.87
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