3-Methoxy-1-butanol - CAS 2517-43-3
Catalog: |
BB018782 |
Product Name: |
3-Methoxy-1-butanol |
CAS: |
2517-43-3 |
Synonyms: |
3-methoxybutan-1-ol |
IUPAC Name: | 3-methoxybutan-1-ol |
Description: | 3-Methoxy-1-butanol (CAS# 2517-43-3) is used as a reactant in the preparation of 3-(1,1-dioxo-2H-(1,2,4)-benzothiadiazin-3-yl)-4-hydroxy-2(1H)-quinolinones as potent inhibitors of Hepatitis C Virus RNA-Dependent RNA Polymerase. |
Molecular Weight: | 104.15 |
Molecular Formula: | C5H12O2 |
Canonical SMILES: | CC(CCO)OC |
InChI: | InChI=1S/C5H12O2/c1-5(7-2)3-4-6/h5-6H,3-4H2,1-2H3 |
InChI Key: | JSGVZVOGOQILFM-UHFFFAOYSA-N |
Boiling Point: | 162.6 °C at 760 mmHg |
Density: | 0.928 g/cm3 |
Appearance: | Clear colourless liquid |
MDL: | MFCD00002931 |
LogP: | 0.40370 |
GHS Hazard Statement: | H226 (100%): Flammable liquid and vapor [Warning Flammable liquids] |
Precautionary Statement: | P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113462225-A | Modified pearlescent mica pigment and preparation method and application thereof | 20210707 |
CN-113185705-A | Organic-inorganic hybrid material for single molecule detection and preparation method thereof | 20210521 |
CN-113150223-A | POSS (polyhedral oligomeric silsesquioxane) modified acrylate resin and high-impedance black matrix photoresist composition thereof | 20210315 |
JP-2021080486-A | Ink set | 20210308 |
CN-112961054-A | Method for iron-catalyzed ethoxycarbonyl difluoromethylation of aromatic compound | 20210219 |
PMID | Publication Date | Title | Journal |
17388430 | 20070329 | Glass transition dynamics and boiling temperatures of molecular liquids and their isomers | The journal of physical chemistry. B |
Complexity: | 37.1 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 104.083729621 |
Formal Charge: | 0 |
Heavy Atom Count: | 7 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 104.083729621 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 29.5 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.2 |
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