3-Oxazolidinecarboxylic acid, 2,2-dimethyl-4-(1-oxo-2-hexadecynyl)-,1,1-dimethylethyl ester, (S)-


Chemical Name: 3-Oxazolidinecarboxylic acid, 2,2-dimethyl-4-(1-oxo-2-hexadecynyl)-,1,1-dimethylethyl ester, (S)-
CAS Number: 120005-55-2
Product Number: AG000Q2V(AGN-PC-0PE3DY)
Synonyms:
MDL No: MFCD18428021
Molecular Formula: C26H45NO4
Molecular Weight: 435.6398

Identification/Properties


Computed Properties
Molecular Weight:
435.649g/mol
XLogP3:
8.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
14
Exact Mass:
435.335g/mol
Monoisotopic Mass:
435.335g/mol
Topological Polar Surface Area:
55.8A^2
Heavy Atom Count:
31
Formal Charge:
0
Complexity:
620
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
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


Other Analytical Data


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