2-Chloro-4-methoxybenzyl bromide - CAS 54788-17-9
Catalog: |
BB028819 |
Product Name: |
2-Chloro-4-methoxybenzyl bromide |
CAS: |
54788-17-9 |
Synonyms: |
1-(bromomethyl)-2-chloro-4-methoxybenzene |
IUPAC Name: | 1-(bromomethyl)-2-chloro-4-methoxybenzene |
Description: | 2-Chloro-4-methoxybenzyl bromide (CAS# 54788-17-9) is a useful research chemical. |
Molecular Weight: | 235.51 |
Molecular Formula: | C8H8BrClO |
Canonical SMILES: | COC1=CC(=C(C=C1)CBr)Cl |
InChI: | InChI=1S/C8H8BrClO/c1-11-7-3-2-6(5-9)8(10)4-7/h2-4H,5H2,1H3 |
InChI Key: | UIOYCWAQKOLSMA-UHFFFAOYSA-N |
Boiling Point: | 275.551 ℃ at 760 mmHg |
Melting Point: | 57-58 ℃ |
Purity: | 95 % |
Density: | 1.521 g/cm3 |
Appearance: | Solid |
MDL: | MFCD08445696 |
LogP: | 3.24350 |
GHS Hazard Statement: | H301 (90.48%): Toxic if swallowed [Danger Acute toxicity, oral]; H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P260, P261, P264, P270, P271, P280, P301+P316, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P319, P321, P330, P363, P403+P233, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
JP-2021102590-A | Hypoxanthine compound | 20191226 |
CA-3030581-A1 | Apoptosis inhibitors | 20160718 |
CN-110023292-A | Apoptosis inhibitor | 20160718 |
EP-3484854-A1 | Apoptosis inhibitors | 20160718 |
JP-2019524739-A | Apoptosis inhibitor | 20160718 |
Complexity: | 121 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 233.94471 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 233.94471 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 9.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.3 |
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