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122456-82-0 | L-Lysine, N6-[(1,1-dimethylethoxy)carbonyl]-, ethyl ester, monohydrochloride (9CI)
CAS No: 122456-82-0 Catalog No: AG00179E MDL No:MFCD23140990
Product Description
Catalog Number:
AG00179E
Chemical Name:
L-Lysine, N6-[(1,1-dimethylethoxy)carbonyl]-, ethyl ester, monohydrochloride (9CI)
CAS Number:
122456-82-0
Molecular Formula:
C13H27ClN2O4
Molecular Weight:
310.8175
MDL Number:
MFCD23140990
IUPAC Name:
ethyl (2S)-2-amino-6-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoate;hydrochloride
InChI:
InChI=1S/C13H26N2O4.ClH/c1-5-18-11(16)10(14)8-6-7-9-15-12(17)19-13(2,3)4;/h10H,5-9,14H2,1-4H3,(H,15,17);1H/t10-;/m0./s1
InChI Key:
SCOLDMVDYLWBST-PPHPATTJSA-N
SMILES:
CCOC(=O)[C@H](CCCCNC(=O)OC(C)(C)C)N.Cl
Properties
Complexity:
287
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
310.166g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
310.819g/mol
Monoisotopic Mass:
310.166g/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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