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68973-27-3 | L-Lysine, L-alanyl-, hydrochloride (1:1)
CAS No: 68973-27-3 Catalog No: AG003AAW MDL No:MFCD00058293
Product Description
Catalog Number:
AG003AAW
Chemical Name:
L-Lysine, L-alanyl-, hydrochloride (1:1)
CAS Number:
68973-27-3
Molecular Formula:
C9H20ClN3O3
Molecular Weight:
253.7264
MDL Number:
MFCD00058293
IUPAC Name:
(2S)-6-amino-2-[[(2S)-2-aminopropanoyl]amino]hexanoic acid;hydrochloride
InChI:
InChI=1S/C9H19N3O3.ClH/c1-6(11)8(13)12-7(9(14)15)4-2-3-5-10;/h6-7H,2-5,10-11H2,1H3,(H,12,13)(H,14,15);1H/t6-,7-;/m0./s1
InChI Key:
JWNUXAHYKKBLRA-LEUCUCNGSA-N
SMILES:
NCCCC[C@@H](C(=O)O)NC(=O)[C@@H](N)C.Cl
Properties
Complexity:
221
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
253.119g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
5
Isotope Atom Count:
0
Molecular Weight:
253.727g/mol
Monoisotopic Mass:
253.119g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
118A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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