1,16-Hexadecanediol - CAS 7735-42-4
Catalog: |
BB035907 |
Product Name: |
1,16-Hexadecanediol |
CAS: |
7735-42-4 |
Synonyms: |
hexadecane-1,16-diol |
IUPAC Name: | hexadecane-1,16-diol |
Description: | 1,16-Hexadecanediol (CAS# 7735-42-4) is a useful research chemical. |
Molecular Weight: | 258.44 |
Molecular Formula: | C16H34O2 |
Canonical SMILES: | C(CCCCCCCCO)CCCCCCCO |
InChI: | InChI=1S/C16H34O2/c17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18/h17-18H,1-16H2 |
InChI Key: | GJBXIPOYHVMPQJ-UHFFFAOYSA-N |
Boiling Point: | 197-199 °C (3 mmHg) |
Melting Point: | 91-94 °C |
Purity: | 95 % |
Density: | 0.898 g/cm3 |
Appearance: | White to almost white powder to crystal |
LogP: | 4.43240 |
Refractive Index: | 1.4760 (estimate) |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P264, P280, P302+P352, P321, P332+P313, and P362 |
Signal Word: | Warning |
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PMID | Publication Date | Title | Journal |
22346750 | 20120201 | Genome-wide transcriptional profiling of appressorium development by the rice blast fungus Magnaporthe oryzae | PLoS pathogens |
22346755 | 20120201 | Different chitin synthase genes are required for various developmental and plant infection processes in the rice blast fungus Magnaporthe oryzae | PLoS pathogens |
22144889 | 20111201 | Two novel transcriptional regulators are essential for infection-related morphogenesis and pathogenicity of the rice blast fungus Magnaporthe oryzae | PLoS pathogens |
21846125 | 20110913 | Biosynthesis of unnatural bacteriochlorophyll c derivatives esterified with α,ω-diols in the green sulfur photosynthetic bacterium Chlorobaculum tepidum | Biochemistry |
21283781 | 20110120 | Multiple plant surface signals are sensed by different mechanisms in the rice blast fungus for appressorium formation | PLoS pathogens |
Complexity: | 121 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 258.255880323 |
Formal Charge: | 0 |
Heavy Atom Count: | 18 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 258.255880323 |
Rotatable Bond Count: | 15 |
Topological Polar Surface Area: | 40.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 5.7 |
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