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693-65-2 | Dipentyl ether
CAS No: 693-65-2 Catalog No: AG003POY MDL No:MFCD00009501
Product Description
Catalog Number:
AG003POY
Chemical Name:
Dipentyl ether
CAS Number:
693-65-2
Molecular Formula:
C10H22O
Molecular Weight:
158.2811
MDL Number:
MFCD00009501
IUPAC Name:
1-pentoxypentane
InChI:
InChI=1S/C10H22O/c1-3-5-7-9-11-10-8-6-4-2/h3-10H2,1-2H3
InChI Key:
AOPDRZXCEAKHHW-UHFFFAOYSA-N
SMILES:
CCCCCOCCCCC
EC Number:
211-756-8
UNII:
4G19C1NH3E
NSC Number:
6571
Properties
Complexity:
53.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
158.167g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
158.285g/mol
Monoisotopic Mass:
158.167g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
Literature
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|---|---|
| Structural and functional analysis of laninamivir and its octanoate prodrug reveals group specific mechanisms for influenza NA inhibition. | PLoS pathogens 20111001 |
| Models for liquid-liquid partition in the system propylene carbonate-organic solvent and their use for estimating descriptors for organic compounds. | Journal of chromatography. A 20110211 |
| Identification and pharmacological characterization of the anti-inflammatory principal of the leaves of dwarf elder (Sambucus ebulus L.). | Journal of ethnopharmacology 20110127 |
| Top-hits for H1N1pdm Identified by Virtual Screening Using Ensemble-based Docking. | PLoS currents 20110103 |
| Ultrafast intramolecular charge transfer with N-(4-cyanophenyl)carbazole. Evidence for a LE precursor and dual LE + ICT fluorescence. | The journal of physical chemistry. A 20101209 |
| Development and validation of a liquid chromatography-tandem mass spectrometry assay for the simultaneous quantitation of prednisolone and dipyridamole in human plasma and its application in a pharmacokinetic study. | Journal of pharmaceutical and biomedical analysis 20090712 |
| Phase equilibria study of the binary systems (1-butyl-3-methylimidazolium thiocyanate ionic liquid + organic solvent or water). | The journal of physical chemistry. B 20090507 |
| Ensemble-based virtual screening reveals potential novel antiviral compounds for avian influenza neuraminidase. | Journal of medicinal chemistry 20080710 |
| Reduced sensitivity of influenza A (H5N1) to oseltamivir. | Emerging infectious diseases 20070901 |
| Simultaneous determination of three isomeric metabolites of tacrolimus (FK506) in human whole blood and plasma using high performance liquid chromatography-tandem mass spectrometry. | Journal of chromatography. B, Analytical technologies in the biomedical and life sciences 20060118 |
| Immobilization of lipases on different carriers and their use in synthesis of pentyl isovalerates. | Preparative biochemistry & biotechnology 20040501 |
| Short-term oral toxicity of pentyl ether, 1,4-diethoxybutane, and 1,6-dimethoxyhexane in male rats. | Toxicological sciences : an official journal of the Society of Toxicology 20040101 |
| Modification of calix[4]arenes with CMPO-functions at the wide rim. Synthesis, solution behavior, and separation of actinides from lanthanides. | Organic & biomolecular chemistry 20031121 |
| Role of organic solvents on Pa-hydroxynitrile lyase interfacial activity and stability. | Biotechnology and bioengineering 20010705 |
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