D-Allothreonine


Chemical Name: D-Allothreonine
CAS Number: 24830-94-2
Product Number: AG002PM9(AGN-PC-0O885H)
Synonyms:
MDL No: MFCD00004526
Molecular Formula: C4H9NO3
Molecular Weight: 119.1192

Identification/Properties


Properties
MP:
276 °C (dec.);(lit.);
BP:
345.8°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Refractive Index:
-10 ° (C=5, H2O)
Computed Properties
Molecular Weight:
119.12g/mol
XLogP3:
-2.9
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
119.058g/mol
Monoisotopic Mass:
119.058g/mol
Topological Polar Surface Area:
83.6A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
93.3
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
2
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


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

NMR Spectrum


Other Analytical Data


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