1-Hexen-3-ol - CAS 4798-44-1
Catalog: |
BB026446 |
Product Name: |
1-Hexen-3-ol |
CAS: |
4798-44-1 |
Synonyms: |
hex-1-en-3-ol |
IUPAC Name: | hex-1-en-3-ol |
Description: | 1-Hexen-3-ol (CAS# 4798-44-1 ) is a useful research chemical. |
Molecular Weight: | 100.16 |
Molecular Formula: | C6H12O |
Canonical SMILES: | CCCC(C=C)O |
InChI: | InChI=1S/C6H12O/c1-3-5-6(7)4-2/h4,6-7H,2-3,5H2,1H3 |
InChI Key: | BVOSSZSHBZQJOI-UHFFFAOYSA-N |
Boiling Point: | 134.00 °C (EPI 4.0) |
Melting Point: | -15°C |
Flash Point: | 35°C |
Purity: | 98.5 % |
Density: | 0.835 g/cm3 |
Solubility: | Insoluble in water; soluble in alcohol. |
Appearance: | Colorless liquid |
Storage: | Store tightly sealed under inert gas in a cool, well-ventilated area. |
LogP: | 1.33340 |
Refractive Index: | 1.425 : 1.431 at 20 deg C |
Stability: | Stable under normal temperatures and pressures. |
GHS Hazard Statement: | H226 (100%): Flammable liquid and vapor [Warning Flammable liquids] |
Precautionary Statement: | P210, P233, P240, P241, P242, P243, P264, P270, P280, P301+P312, P303+P361+P353, P330, P370+P378, P403+P235, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
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PMID | Publication Date | Title | Journal |
23017416 | 20130101 | Determination of volatile compounds in New Zealand Greenshell™ mussels (Perna canaliculus) during chilled storage using solid phase microextraction gas chromatography-mass spectrometry | Food chemistry |
22894125 | 20120601 | Efficacy of three attractant blends tested in combination with carbon dioxide against natural populations of mosquitoes and biting flies at the Lower Suwannee Wildlife Refuge | Journal of the American Mosquito Control Association |
19769036 | 20090901 | Lutzomyia spp. (Diptera: Psychodidae) response to olfactory attractant- and light emitting diode-modified Mosquito Magnet X (MM-X) traps | Journal of medical entomology |
Complexity: | 50.1 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 100.088815002 |
Formal Charge: | 0 |
Heavy Atom Count: | 7 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 100.088815002 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 20.2 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.5 |
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