1,3-Octadecanediol, 2-amino-, (2S,3R)-


Chemical Name: 1,3-Octadecanediol, 2-amino-, (2S,3R)-
CAS Number: 764-22-7
Product Number: AG00G3CL(AGN-PC-0OHT89)
Synonyms:
MDL No:
Molecular Formula: C18H39NO2
Molecular Weight: 301.5078

Identification/Properties


Computed Properties
Molecular Weight:
301.515g/mol
XLogP3:
5.8
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
16
Exact Mass:
301.298g/mol
Monoisotopic Mass:
301.298g/mol
Topological Polar Surface Area:
66.5A^2
Heavy Atom Count:
21
Formal Charge:
0
Complexity:
200
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

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NMR Spectrum


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