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2363-86-2 | Octanal, 2-oxo-
CAS No: 2363-86-2 Catalog No: AG002NYG MDL No:
Product Description
Catalog Number:
AG002NYG
Chemical Name:
Octanal, 2-oxo-
CAS Number:
2363-86-2
Molecular Formula:
C8H14O2
Molecular Weight:
142.1956
IUPAC Name:
2-oxooctanal
InChI:
InChI=1S/C8H14O2/c1-2-3-4-5-6-8(10)7-9/h7H,2-6H2,1H3
InChI Key:
MWDGNKGKLOBESZ-UHFFFAOYSA-N
SMILES:
CCCCCCC(=O)C=O
Properties
Complexity:
108
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
142.099g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
142.198g/mol
Monoisotopic Mass:
142.099g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
34.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Literature
| Title | Journal |
|---|---|
| Potent inhibition of Acid ceramidase by novel B-13 analogues. | Journal of lipids 20110101 |
| Exome-sequencing confirms DNAJC5 mutations as cause of adult neuronal ceroid-lipofuscinosis. | PloS one 20110101 |
| Role of gap junctions in early brain injury following subarachnoid hemorrhage. | Brain research 20100222 |
| Design, synthesis and activity as acid ceramidase inhibitors of 2-oxooctanoyl and N-oleoylethanolamine analogues. | Chemistry and physics of lipids 20061001 |
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