3,5-Dimethoxybenzyl bromide - CAS 877-88-3
Catalog: |
BB038633 |
Product Name: |
3,5-Dimethoxybenzyl bromide |
CAS: |
877-88-3 |
Synonyms: |
1-(bromomethyl)-3,5-dimethoxybenzene |
IUPAC Name: | 1-(bromomethyl)-3,5-dimethoxybenzene |
Description: | Reagent used in dimethoxybenzene alkyl addition. |
Molecular Weight: | 231.09 |
Molecular Formula: | C9H11BrO2 |
Canonical SMILES: | COC1=CC(=CC(=C1)CBr)OC |
InChI: | InChI=1S/C9H11BrO2/c1-11-8-3-7(6-10)4-9(5-8)12-2/h3-5H,6H2,1-2H3 |
InChI Key: | BTHIGJGJAPYFSJ-UHFFFAOYSA-N |
Boiling Point: | 292.1 °C at 760 mmHg |
Melting Point: | 69-70 °C |
Purity: | 95 % |
Density: | 1.384 g/cm3 |
Appearance: | White to almost white powder to crystal |
Storage: | Refrigerator |
MDL: | MFCD01321368 |
LogP: | 2.59870 |
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 |
CN-112538025-A | Preparation method of fluorine-containing compound for hydrophobic surface treatment agent | 20201208 |
CN-112028750-A | Perfluoroalkyl ether and preparation and application thereof | 20200827 |
CN-111499616-A | Aromatic heterocycle substituted quinazolinone derivative and synthesis method and application thereof | 20200507 |
JP-2021102590-A | Hypoxanthine compound | 20191226 |
US-2021179570-A1 | Processes and intermediates for preparing mcl1 inhibitors | 20191126 |
PMID | Publication Date | Title | Journal |
15606087 | 20041223 | Isomeric [2]rotaxanes and unidirectional [2]pseudorotaxane composed of alpha-cyclodextrin and aliphatic chain-linked carbazole-viologen compounds | Organic letters |
Complexity: | 118 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 229.99424 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 229.99424 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 18.5 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.4 |
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