3-Phenyl-1-indanone - CAS 16618-72-7
Catalog: |
BB012252 |
Product Name: |
3-Phenyl-1-indanone |
CAS: |
16618-72-7 |
Synonyms: |
3-phenyl-2,3-dihydroinden-1-one |
IUPAC Name: | 3-phenyl-2,3-dihydroinden-1-one |
Description: | 3-Phenyl-1-indanone (CAS# 16618-72-7) is a useful research chemical. |
Molecular Weight: | 208.26 |
Molecular Formula: | C15H12O |
Canonical SMILES: | C1C(C2=CC=CC=C2C1=O)C3=CC=CC=C3 |
InChI: | InChI=1S/C15H12O/c16-15-10-14(11-6-2-1-3-7-11)12-8-4-5-9-13(12)15/h1-9,14H,10H2 |
InChI Key: | SIUOTMYWHGODQX-UHFFFAOYSA-N |
Boiling Point: | 148 °C (0.7 torr) |
Melting Point: | 76-78 °C |
Purity: | 95 % |
Density: | 1.162 g/cm3 |
MDL: | MFCD00037722 |
LogP: | 3.40490 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P301+P312, P330, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021162115-A1 | Laminate, display device, and organic electroluminescence display device | 20200213 |
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JP-2021098856-A | Compounds, polymerizable compositions and cured products | 20191223 |
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PMID | Publication Date | Title | Journal |
21275055 | 20110207 | Synthesis and evaluation of indatraline-based inhibitors for trypanothione reductase | ChemMedChem |
19230703 | 20090501 | Gas-phase nazarov cyclization of protonated 2-methoxy and 2-hydroxychalcone: an example of intramolecular proton-transport catalysis | Journal of the American Society for Mass Spectrometry |
Complexity: | 265 |
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: | 1 |
Topological Polar Surface Area: | 17.1 Å2 |
Undefined Atom Stereocenter Count: | 1 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.1 |
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