2-Bromo-2',4'-dimethoxyacetophenone - CAS 60965-26-6
Catalog: |
BB030870 |
Product Name: |
2-Bromo-2',4'-dimethoxyacetophenone |
CAS: |
60965-26-6 |
Synonyms: |
2-bromo-1-(2,4-dimethoxyphenyl)ethanone |
IUPAC Name: | 2-bromo-1-(2,4-dimethoxyphenyl)ethanone |
Description: | 2-Bromo-2',4'-dimethoxyacetophenone (CAS# 60965-26-6) is a useful research chemical. |
Molecular Weight: | 259.10 |
Molecular Formula: | C10H11BrO3 |
Canonical SMILES: | COC1=CC(=C(C=C1)C(=O)CBr)OC |
InChI: | InChI=1S/C10H11BrO3/c1-13-7-3-4-8(9(12)6-11)10(5-7)14-2/h3-5H,6H2,1-2H3 |
InChI Key: | PKVBZABQCCQHLD-UHFFFAOYSA-N |
Boiling Point: | 348.2 ℃ at 760 mmHg |
Melting Point: | 101-105 ℃ |
Purity: | 98 % |
Density: | 1.422 g/cm3 |
Appearance: | White to brown fine crystalline powder |
MDL: | MFCD00000197 |
LogP: | 2.28140 |
GHS Hazard Statement: | H314 (11.36%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] |
Precautionary Statement: | P260, P261, P264, P271, P280, P301+P330+P331, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
KR-20200012316-A | 1,3,4-Oxadiazole Derivative Compounds as Histone Deacetylase 6 Inhibitor, and the Pharmaceutical Composition Comprising the same | 20180726 |
WO-2020022794-A1 | 1,3,4-oxadiazole derivative compounds as histone deacetylase 6 inhibitor, and pharmaceutical composition comprising the same | 20180726 |
TW-202019917-A | 1,3,4-oxadiazole derivatives as histone deacetylase 6 inhibitors and pharmaceutical compositions containing them | 20180726 |
AU-2019310508-A1 | 1,3,4-oxadiazole derivative compounds as histone deacetylase 6 inhibitor, and pharmaceutical composition comprising the same | 20180726 |
CA-3105662-A1 | 1,3,4-oxadiazole derivative compounds as histone deacetylase 6 inhibitor, and pharmaceutical composition comprising the same | 20180726 |
Complexity: | 196 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 257.98916 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 257.98916 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 35.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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