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13288-57-8 | L-Lysine, N6-[(1,1-dimethylethoxy)carbonyl]-, 1,1-dimethylethyl ester, hydrochloride (1:1)
CAS No: 13288-57-8 Catalog No: AG0011C7 MDL No:MFCD00038899
Product Description
Catalog Number:
AG0011C7
Chemical Name:
L-Lysine, N6-[(1,1-dimethylethoxy)carbonyl]-, 1,1-dimethylethyl ester, hydrochloride (1:1)
CAS Number:
13288-57-8
Molecular Formula:
C15H31ClN2O4
Molecular Weight:
338.8706
MDL Number:
MFCD00038899
IUPAC Name:
tert-butyl (2S)-2-amino-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoate;hydrochloride
InChI:
InChI=1S/C15H30N2O4.ClH/c1-14(2,3)20-12(18)11(16)9-7-8-10-17-13(19)21-15(4,5)6;/h11H,7-10,16H2,1-6H3,(H,17,19);1H/t11-;/m0./s1
InChI Key:
TZBPQINFXPIRBX-MERQFXBCSA-N
SMILES:
O=C(OC(C)(C)C)NCCCC[C@@H](C(=O)OC(C)(C)C)N.Cl
Properties
Complexity:
343
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
338.197g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
338.873g/mol
Monoisotopic Mass:
338.197g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
90.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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