β-Phenylcinnamaldehyde - CAS 1210-39-5
Catalog: |
BB005022 |
Product Name: |
β-Phenylcinnamaldehyde |
CAS: |
1210-39-5 |
Synonyms: |
3,3-diphenylprop-2-enal |
IUPAC Name: | 3,3-diphenylprop-2-enal |
Description: | β-Phenylcinnamaldehyde (CAS# 1210-39-5 ) is a useful research chemical. |
Molecular Weight: | 208.26 |
Molecular Formula: | C15H12O |
Canonical SMILES: | C1=CC=C(C=C1)C(=CC=O)C2=CC=CC=C2 |
InChI: | InChI=1S/C15H12O/c16-12-11-15(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-12H |
InChI Key: | MWAFWBDWAWZJGK-UHFFFAOYSA-N |
Boiling Point: | 195-200 °C17 mmHg (lit.) |
Melting Point: | 44-46 °C(lit.) |
Purity: | 95 % |
Density: | 1.072 g/cm3 |
MDL: | MFCD00006996 |
LogP: | 3.31720 |
GHS Hazard Statement: | H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin] |
Precautionary Statement: | P261, P272, P280, P302+P352, P321, P333+P313, P363, and P501 |
Signal Word: | Warning |
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CN-111116693-A | Method for preparing sofosbuvir by combining 3, 3-diaryl acrolein and Grignard reagent | 20191227 |
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PMID | Publication Date | Title | Journal |
19725977 | 20090902 | Emerging role of Garcinol, the antioxidant chalcone from Garcinia indica Choisy and its synthetic analogs | Journal of hematology & oncology |
15989328 | 20050708 | Oxidative coupling of benzenes with alpha,beta-unsaturated aldehydes by the Pd(OAc)2/molybdovanadophosphoric acid/O2 system | The Journal of organic chemistry |
15568082 | 20041207 | [Ru(eta3-2-C3H4Me)(CO)(dppf)][SbF6]: a mononuclear 16e - ruthenium(II) catalyst for propargylic substitution and isomerization of HC[triple bond]CCPh2(OH) | Chemical communications (Cambridge, England) |
Complexity: | 222 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 208.088815002 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 208.088815002 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 17.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.7 |
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