Benzaldehyde Propylene Glycol Acetal - CAS 2568-25-4
Catalog: |
BB019005 |
Product Name: |
Benzaldehyde Propylene Glycol Acetal |
CAS: |
2568-25-4 |
Synonyms: |
4-methyl-2-phenyl-1,3-dioxolane; 4-methyl-2-phenyl-1,3-dioxolane |
IUPAC Name: | 4-methyl-2-phenyl-1,3-dioxolane |
Description: | Benzaldehyde Propylene Glycol Acetal (CAS# 2568-25-4) is a building block used in various chemical synthesis. |
Molecular Weight: | 164.20 |
Molecular Formula: | C10H12O2 |
Canonical SMILES: | CC1COC(O1)C2=CC=CC=C2 |
InChI: | InChI=1S/C10H12O2/c1-8-7-11-10(12-8)9-5-3-2-4-6-9/h2-6,8,10H,7H2,1H3 |
InChI Key: | CDIKGISJRLTLRA-UHFFFAOYSA-N |
Boiling Point: | 83-85 °C (4 mmHg) |
Flash Point: | >110°C |
Density: | 1.065 g/cm3 |
Solubility: | slightly soluble in water; soluble in oils |
Appearance: | Colorless to yellow liquid |
MDL: | MFCD00059732 |
LogP: | 2.12050 |
Refractive Index: | 1.509 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
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PMID | Publication Date | Title | Journal |
15822150 | 20050501 | Synthesis of acetals and ketals catalyzed by tungstosilicic acid supported on active carbon | Journal of Zhejiang University. Science. B |
14529016 | 20030901 | Ion/molecule reactions performed in a miniature cylindrical ion trap mass spectrometer | The Analyst |
Complexity: | 141 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 164.083729621 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 164.083729621 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 18.5 Å2 |
Undefined Atom Stereocenter Count: | 2 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.8 |
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