(2S)-2,5-diamino-2-(difluoromethyl)pentanoic acid;hydrochloride


Chemical Name: (2S)-2,5-diamino-2-(difluoromethyl)pentanoic acid;hydrochloride
CAS Number: 68278-23-9
Product Number: AG00IBT4(AGN-PC-00S4RR)
Synonyms:
MDL No: MFCD00242734
Molecular Formula: C6H13ClF2N2O2
Molecular Weight: 218.6294

Identification/Properties


Computed Properties
Molecular Weight:
218.629g/mol
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
5
Exact Mass:
218.063g/mol
Monoisotopic Mass:
218.063g/mol
Topological Polar Surface Area:
89.3A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
166
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
2
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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