2-Bromo-4-nitrobenzyl Bromide - CAS 940-05-6
Catalog: |
BB041168 |
Product Name: |
2-Bromo-4-nitrobenzyl Bromide |
CAS: |
940-05-6 |
Synonyms: |
2-bromo-1-(bromomethyl)-4-nitrobenzene; 2-bromo-1-(bromomethyl)-4-nitrobenzene |
IUPAC Name: | 2-bromo-1-(bromomethyl)-4-nitrobenzene |
Description: | 2-Bromo-4-nitrobenzyl Bromide (CAS# 940-05-6) is a useful research chemical compound. |
Molecular Weight: | 294.93 |
Molecular Formula: | C7H5Br2NO2 |
Canonical SMILES: | C1=CC(=C(C=C1[N+](=O)[O-])Br)CBr |
InChI: | InChI=1S/C7H5Br2NO2/c8-4-5-1-2-6(10(11)12)3-7(5)9/h1-3H,4H2 |
InChI Key: | IHNSPLNYBYYNKQ-UHFFFAOYSA-N |
Boiling Point: | 348 °C at 760 mmHg |
Density: | 2.006 g/cm3 |
MDL: | MFCD11100213 |
LogP: | 3.77540 |
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-112608320-A | Piperidine compound and preparation method and medical application thereof | 20200116 |
WO-2021143792-A1 | Piperidine compound, preparation method therefor and medical use thereof | 20200116 |
WO-2020214999-A1 | Abelson non-tyrosine kinase compounds for the treatment of neurodegenerative diseases | 20190417 |
WO-2008144483-A2 | Agents for treating disorders involving modulation of ryanodine receptors | 20070518 |
EP-1844768-A1 | Aromatic sulfone compound as aldosterone receptor modulator | 20050119 |
Complexity: | 171 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 294.86665 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 292.86870 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 45.8 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3 |
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