Alfacalcidol-D6


Chemical Name: Alfacalcidol-D6
CAS Number: 1641940-94-4
Product Number: AG00ABII(AGN-00ABCY)
Synonyms:
MDL No:
Molecular Formula: C27H38D6O2
Molecular Weight: 406.6740

Identification/Properties


Computed Properties
Molecular Weight:
406.684g/mol
XLogP3:
6.8
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
6
Exact Mass:
406.372g/mol
Monoisotopic Mass:
406.372g/mol
Topological Polar Surface Area:
40.5A^2
Heavy Atom Count:
29
Formal Charge:
0
Complexity:
643
Isotope Atom Count:
6
Defined Atom Stereocenter Count:
6
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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