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69646-00-0 | HEXADECANOATE
CAS No: 69646-00-0 Catalog No: AG005JWG MDL No:
Product Description
Catalog Number:
AG005JWG
Chemical Name:
HEXADECANOATE
CAS Number:
69646-00-0
Molecular Formula:
C16H31O2-
Molecular Weight:
255.4161
IUPAC Name:
hexadecanoate
InChI:
InChI=1S/C16H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h2-15H2,1H3,(H,17,18)/p-1
InChI Key:
IPCSVZSSVZVIGE-UHFFFAOYSA-M
SMILES:
CCCCCCCCCCCCCCCC(=O)[O-]
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.232g/mol
Formal Charge:
-1
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
255.422g/mol
Monoisotopic Mass:
255.232g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
40.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7
Literature
| Title | Journal |
|---|---|
| Anti-inflammatory property of n-hexadecanoic acid: structural evidence and kinetic assessment. | Chemical biology & drug design 20120901 |
| Structural and thermodynamic studies of binding saturated fatty acids to bovine β-lactoglobulin. | International journal of biological macromolecules 20120501 |
| Crystal structure of the Mp1p ligand binding domain 2 reveals its function as a fatty acid-binding protein. | The Journal of biological chemistry 20100319 |
| A palmitoylation switch mechanism in the regulation of the visual cycle. | Cell 20040611 |
| Metabolism of hexadecyltrimethylammonium chloride in Pseudomonas strain B1. | Applied and environmental microbiology 19920901 |
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