DL-Threonine, hydrate (2:1)


Chemical Name: DL-Threonine, hydrate (2:1)
CAS Number: 6028-28-0
Product Number: AG00IAOD(AGN-PC-0OD2S2)
Synonyms:
MDL No:
Molecular Formula: C8H20N2O7
Molecular Weight: 256.2536

Identification/Properties


Computed Properties
Molecular Weight:
256.255g/mol
Hydrogen Bond Donor Count:
7
Hydrogen Bond Acceptor Count:
9
Rotatable Bond Count:
4
Exact Mass:
256.127g/mol
Monoisotopic Mass:
256.127g/mol
Topological Polar Surface Area:
168A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
93.3
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
4
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
3
Compound Is Canonicalized:
Yes

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NMR Spectrum


Other Analytical Data


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