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16012-55-8 | L-Alanine, 3-(methylamino)-, hydrochloride (1:1)
CAS No: 16012-55-8 Catalog No: AG001ROG MDL No:MFCD00055227
Product Description
Catalog Number:
AG001ROG
Chemical Name:
L-Alanine, 3-(methylamino)-, hydrochloride (1:1)
CAS Number:
16012-55-8
Molecular Formula:
C4H11ClN2O2
Molecular Weight:
154.5953
MDL Number:
MFCD00055227
IUPAC Name:
(2S)-2-amino-3-(methylamino)propanoic acid;hydrochloride
InChI:
InChI=1S/C4H10N2O2.ClH/c1-6-2-3(5)4(7)8;/h3,6H,2,5H2,1H3,(H,7,8);1H/t3-;/m0./s1
InChI Key:
VDXYGASOGLSIDM-DFWYDOINSA-N
SMILES:
CNC[C@@H](C(=O)O)N.Cl
Properties
Complexity:
84.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
154.051g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
154.594g/mol
Monoisotopic Mass:
154.051g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
75.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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