2,3-Dimethylnaphthalene - CAS 581-40-8
Catalog: |
BB029948 |
Product Name: |
2,3-Dimethylnaphthalene |
CAS: |
581-40-8 |
Synonyms: |
2,3-dimethylnaphthalene |
IUPAC Name: | 2,3-dimethylnaphthalene |
Description: | 2,3-Dimethylnaphthalene (CAS# 581-40-8) is a useful research chemical. |
Molecular Weight: | 156.22 |
Molecular Formula: | C12H12 |
Canonical SMILES: | CC1=CC2=CC=CC=C2C=C1C |
InChI: | InChI=1S/C12H12/c1-9-7-11-5-3-4-6-12(11)8-10(9)2/h3-8H,1-2H3 |
InChI Key: | WWGUMAYGTYQSGA-UHFFFAOYSA-N |
Boiling Point: | 269 °C (lit.) |
Density: | 1 g/cm3 |
Solubility: | Solubility in toluene (almost transparency). Insoluble in water. |
Appearance: | White flakes |
MDL: | MFCD00004119 |
LogP: | 3.45660 |
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 |
CN-113016986-A | Method for improving flavor substances of day lily | 20210329 |
CN-113122315-A | Method for treating ethylene tar and use of carbonyl compound containing olefinic bond | 20200115 |
WO-2021135725-A1 | Organic compound, electronic device and electronic apparatus using same | 20191231 |
CN-110632207-A | Method for identifying mold based on volatile gas components and evolution trend thereof | 20191010 |
JP-2021018911-A | Excipients for electrolytes, electrolytes, and lithium batteries | 20190719 |
PMID | Publication Date | Title | Journal |
21218222 | 20110207 | Single dibenzoterrylene molecules in naphthalene and 2,3-dimethylnaphthalene crystals: vibronic spectra | Physical chemistry chemical physics : PCCP |
21185771 | 20110201 | Spectroscopic (FTIR and FT Raman) analysis and vibrational study on 2,3-dimethyl naphthalene using ab-initio HF and DFT calculations | Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy |
20127188 | 20100601 | Whole effluent assessment of industrial wastewater for determination of BAT compliance. Part 2: metal surface treatment industry | Environmental science and pollution research international |
20140711 | 20100501 | Whole effluent assessment of industrial wastewater for determination of bat compliance: Part 1: Paper manufacturing industry | Environmental science and pollution research international |
19212594 | 20090201 | Results of a 'Whole Effluent Assessment' study from different industrial sectors in Germany according to OSPAR's WEA strategy | Journal of environmental monitoring : JEM |
Complexity: | 132 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 156.093900383 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 0 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 156.093900383 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 0 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.4 |
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