Phenylacetaldehyde dimethyl acetal - CAS 101-48-4
Catalog: |
BB000519 |
Product Name: |
Phenylacetaldehyde dimethyl acetal |
CAS: |
101-48-4 |
Synonyms: |
2,2-dimethoxyethylbenzene |
IUPAC Name: | 2,2-dimethoxyethylbenzene |
Description: | Phenylacetaldehyde dimethyl acetal (CAS# 101-48-4) is a useful research chemical. |
Molecular Weight: | 166.22 |
Molecular Formula: | C10H14O2 |
Canonical SMILES: | COC(CC1=CC=CC=C1)OC |
InChI: | InChI=1S/C10H14O2/c1-11-10(12-2)8-9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3 |
InChI Key: | WNJSKZBEWNVKGU-UHFFFAOYSA-N |
Boiling Point: | 219-221 °C |
Flash Point: | 83°C |
Purity: | 95 % |
Density: | 1.004 g/cm3 |
Solubility: | water, 1439 mg/L @ 25 °C (est) |
Appearance: | Clear liquid |
MDL: | MFCD00008487 |
LogP: | 1.84800 |
Refractive Index: | 1.493 |
GHS Hazard Statement: | H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation] |
Precautionary Statement: | P264, P280, P305+P351+P338, and P337+P313 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
JP-2021152083-A | Pest control method | 20210702 |
JP-2021152084-A | Pest control method | 20210702 |
JP-2021152085-A | Pest control method | 20210702 |
JP-2021138753-A | Pest control method for harmful arthropods using heterocyclic compounds | 20210610 |
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PMID | Publication Date | Title | Journal |
20538468 | 20100715 | Anti-influenza activity of phenethylphenylphthalimide analogs derived from thalidomide | Bioorganic & medicinal chemistry |
18093835 | 20080301 | Synthesis and antiproliferative activity of benzyl and phenethyl analogs of makaluvamines | Bioorganic & medicinal chemistry |
Complexity: | 104 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 166.099379685 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 166.099379685 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 18.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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