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126127-31-9 | Hexadecanamide, N-[2-hydroxy-1-(hydroxymethyl)ethyl]-
CAS No: 126127-31-9 Catalog No: AG000RQC MDL No:MFCD05863968
Product Description
Catalog Number:
AG000RQC
Chemical Name:
Hexadecanamide, N-[2-hydroxy-1-(hydroxymethyl)ethyl]-
CAS Number:
126127-31-9
Molecular Formula:
C19H39NO3
Molecular Weight:
329.5179
MDL Number:
MFCD05863968
IUPAC Name:
N-(1,3-dihydroxypropan-2-yl)hexadecanamide
InChI:
InChI=1S/C19H39NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19(23)20-18(16-21)17-22/h18,21-22H,2-17H2,1H3,(H,20,23)
InChI Key:
MZUNFYMZKTWADX-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCCCCCCC(=O)NC(CO)CO
Properties
Complexity:
255
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
329.293g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
329.525g/mol
Monoisotopic Mass:
329.293g/mol
Rotatable Bond Count:
17
Topological Polar Surface Area:
69.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.6
Literature
| Title | Journal |
|---|---|
| Synthesis and characterization of novel ceramide analogs for induction of apoptosis in human cancer cells. | Cancer letters 20020708 |
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