3,4-Dimethylanisole - CAS 4685-47-6
Catalog: |
BB026185 |
Product Name: |
3,4-Dimethylanisole |
CAS: |
4685-47-6 |
Synonyms: |
4-methoxy-1,2-dimethylbenzene |
IUPAC Name: | 4-methoxy-1,2-dimethylbenzene |
Description: | 3,4-Dimethylanisole, can be used as starting reagent in the synthesis of 3- and 4-methoxy-N-hydroxyphthalimide. |
Molecular Weight: | 136.19 |
Molecular Formula: | C9H12O |
Canonical SMILES: | CC1=C(C=C(C=C1)OC)C |
InChI: | InChI=1S/C9H12O/c1-7-4-5-9(10-3)6-8(7)2/h4-6H,1-3H3 |
InChI Key: | LVUBSVWMOWKPDJ-UHFFFAOYSA-N |
Boiling Point: | 200-201 °C |
Purity: | 95 % |
Density: | 0.974 g/cm3 |
Appearance: | Colorless liquid |
MDL: | MFCD00008396 |
LogP: | 2.31200 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-113429302-A | Naphthofluorene derivative, luminescent material, luminescent element and consumer product | 20210827 |
CN-113429348-A | Anthracene imidazole derivative, organic electroluminescent material and consumer product | 20210827 |
CN-113429385-A | Thioxanthene derivatives and their use | 20210827 |
CN-113429393-A | Anthracene-indole derivative, material for organic electroluminescent element, light-emitting element, and consumer product | 20210826 |
CN-113429395-A | Imidazole derivative, organic electroluminescent material, light-emitting element, and consumer product | 20210727 |
PMID | Publication Date | Title | Journal |
11250592 | 20010301 | 1-(Dibromomethyl)-4-methoxy-2-methylbenzene | Acta crystallographica. Section C, Crystal structure communications |
Complexity: | 101 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 136.088815002 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 136.088815002 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 9.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.2 |
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