4-Ethoxy-3-formylphenylboronic acid - CAS 480424-63-3
Catalog: |
BB026459 |
Product Name: |
4-Ethoxy-3-formylphenylboronic acid |
CAS: |
480424-63-3 |
Synonyms: |
(4-ethoxy-3-formylphenyl)boronic acid |
IUPAC Name: | (4-ethoxy-3-formylphenyl)boronic acid |
Description: | 4-Ethoxy-3-formylphenylboronic acid (CAS# 480424-63-3) is a useful research chemical. |
Molecular Weight: | 193.99 |
Molecular Formula: | C9H11BO4 |
Canonical SMILES: | B(C1=CC(=C(C=C1)OCC)C=O)(O)O |
InChI: | InChI=1S/C9H11BO4/c1-2-14-9-4-3-8(10(12)13)5-7(9)6-11/h3-6,12-13H,2H2,1H3 |
InChI Key: | ODRRAKCLFURNFU-UHFFFAOYSA-N |
Boiling Point: | 399.962 ℃ at 760 mmHg |
Melting Point: | 175-189 ℃ |
Purity: | 95 % |
Density: | 1.218 g/cm3 |
Appearance: | White to tan powder, crystals, crystalline powder and/or chunks |
Storage: | 2-8 ℃ |
MDL: | MFCD06801740 |
LogP: | -0.42240 |
GHS Hazard Statement: | H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation] |
Precautionary Statement: | P260, P264, P280, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P363, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
WO-2012150206-A2 | Novel cyclopropanoic acid ester derivatives as pest control agents | 20110504 |
WO-2012150207-A1 | Use of cyclopropanecarboxylic acid ester derivatives for controlling insecticide-resistant insects | 20110504 |
JP-2012102073-A | (Trifluorovinyl) benzenes and process for producing the same | 20100917 |
JP-5833392-B2 | (Trifluorovinyl) benzenes and process for producing the same | 20100917 |
WO-2011085269-A1 | Raf kinase inhibitors | 20100108 |
Complexity: | 186 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 194.0750390 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 194.0750390 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 66.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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