Methyl 4-(Bromomethyl)phenylacetate - CAS 7398-42-7
Catalog: |
BB034967 |
Product Name: |
Methyl 4-(Bromomethyl)phenylacetate |
CAS: |
7398-42-7 |
Synonyms: |
2-[4-(bromomethyl)phenyl]acetic acid methyl ester; methyl 2-[4-(bromomethyl)phenyl]acetate |
IUPAC Name: | methyl 2-[4-(bromomethyl)phenyl]acetate |
Description: | Methyl 4-(Bromomethyl)phenylacetate (CAS# 7398-42-7) is a useful research chemical. |
Molecular Weight: | 243.10 |
Molecular Formula: | C10H11BrO2 |
Canonical SMILES: | COC(=O)CC1=CC=C(C=C1)CBr |
InChI: | InChI=1S/C10H11BrO2/c1-13-10(12)6-8-2-4-9(7-11)5-3-8/h2-5H,6-7H2,1H3 |
InChI Key: | APXOMRFLJBRHNX-UHFFFAOYSA-N |
Boiling Point: | 290.597 °C at 760 mmHg |
Density: | 1.416 g/cm3 |
LogP: | 2.29700 |
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 |
KR-20210122708-A | HMG-CoA Reductase Degradation Inducing Compound | 20200330 |
WO-2021201577-A1 | Hmg-coa reductase degradation inducing compound | 20200330 |
JP-2021102590-A | Hypoxanthine compound | 20191226 |
JP-2020128368-A | Medicine containing an azole-substituted pyridine compound as an active ingredient | 20190208 |
US-2020174006-A1 | Styryl phenols, derivatives and their use in methods of analyte detection | 20181204 |
Complexity: | 162 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 241.99424 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 241.99424 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 26.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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