Butyl 2-methylbutyrate - CAS 15706-73-7
Catalog: |
BB011288 |
Product Name: |
Butyl 2-methylbutyrate |
CAS: |
15706-73-7 |
Synonyms: |
butyl 2-methylbutanoate |
IUPAC Name: | butyl 2-methylbutanoate |
Description: | Butyl 2-methylbutyrate (CAS# 15706-73-7 ) is a useful research chemical. |
Molecular Weight: | 158.24 |
Molecular Formula: | C9H18O2 |
Canonical SMILES: | CCCCOC(=O)C(C)CC |
InChI: | InChI=1S/C9H18O2/c1-4-6-7-11-9(10)8(3)5-2/h8H,4-7H2,1-3H3 |
InChI Key: | OTKQNSSMCDLVQV-UHFFFAOYSA-N |
Boiling Point: | 176.5 °C at 760 mmHg |
Melting Point: | 174-176 °C |
Flash Point: | 59.4°C |
Purity: | 95 % |
Density: | 0.874 g/cm3 |
Appearance: | Colorless clear liquid |
MDL: | MFCD00042902 |
LogP: | 2.37580 |
Refractive Index: | 1.416 |
GHS Hazard Statement: | H226 (97.99%): 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-112796121-A | Environment-friendly plant dye formula and blending method | 20210107 |
CN-112768248-A | Low-temperature-resistant electrolyte for aluminum electrolytic capacitor | 20210106 |
RU-2748167-C1 | Strawberry food flavoring | 20201020 |
CN-111938281-A | Production process of lavender incense jewelry | 20200826 |
WO-2021191310-A1 | Hybrid sensor method | 20200325 |
PMID | Publication Date | Title | Journal |
21209854 | 20101230 | Differential attraction of malaria mosquitoes to volatile blends produced by human skin bacteria | PloS one |
Complexity: | 110 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 158.130679813 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 158.130679813 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 26.3 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.8 |
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