4-Methoxy-2-nitrobenzyl Bromide - CAS 57559-52-1
Catalog: |
BB029749 |
Product Name: |
4-Methoxy-2-nitrobenzyl Bromide |
CAS: |
57559-52-1 |
Synonyms: |
1-(bromomethyl)-4-methoxy-2-nitrobenzene; 1-(bromomethyl)-4-methoxy-2-nitrobenzene |
IUPAC Name: | 1-(bromomethyl)-4-methoxy-2-nitrobenzene |
Description: | 4-Methoxy-2-nitrobenzyl Bromide (CAS# 57559-52-1) is a useful research chemical. |
Molecular Weight: | 246.06 |
Molecular Formula: | C8H8BrNO3 |
Canonical SMILES: | COC1=CC(=C(C=C1)CBr)[N+](=O)[O-] |
InChI: | InChI=1S/C8H8BrNO3/c1-13-7-3-2-6(5-9)8(4-7)10(11)12/h2-4H,5H2,1H3 |
InChI Key: | WZFGFNGYZZHELE-UHFFFAOYSA-N |
Boiling Point: | 330.5 ℃ at 760 mmHg |
Density: | 1.589 g/cm3 |
Appearance: | Solid |
LogP: | 3.02150 |
Publication Number | Title | Priority Date |
WO-2021011722-A1 | Molecules having certain pesticidal utilities, and intermediates, compositions, and processes related thereto | 20190717 |
WO-2018138692-A1 | Novel fungicidal carbamate compounds | 20170130 |
JP-2014097988-A | Photocleavable labeled nucleotides and nucleosides and labeled nucleotides and nucleosides and their use in DNA sequencing | 20131220 |
JP-5781589-B2 | Photocleavable labeled nucleotides and nucleosides and labeled nucleotides and nucleosides and their use in DNA sequencing | 20131220 |
AU-2013305970-A1 | Antibodies to aripiprazole haptens and use thereof | 20120821 |
Complexity: | 183 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 244.96876 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 244.96876 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 55 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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