4-Bromo-2-methoxypyridine - CAS 100367-39-3
Catalog: |
BB000195 |
Product Name: |
4-Bromo-2-methoxypyridine |
CAS: |
100367-39-3 |
Synonyms: |
4-bromo-2-methoxypyridine; 4-bromo-2-methoxypyridine |
IUPAC Name: | 4-bromo-2-methoxypyridine |
Description: | 4-Bromo-2-methoxypyridine (CAS# 100367-39-3) is a useful research chemical. |
Molecular Weight: | 188.02 |
Molecular Formula: | C6H6BrNO |
Canonical SMILES: | COC1=NC=CC(=C1)Br |
InChI: | InChI=1S/C6H6BrNO/c1-9-6-4-5(7)2-3-8-6/h2-4H,1H3 |
InChI Key: | YFTGMMXMLPTTAY-UHFFFAOYSA-N |
Boiling Point: | 202.3 °C at 760 mmHg |
Density: | 1.53 g/cm3 |
Appearance: | Low melting solid |
Storage: | Keep in dark place, Inert atmosphere, 2-8 °C |
MDL: | MFCD08277268 |
LogP: | 1.85270 |
GHS Hazard Statement: | H302 (25%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
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Complexity: | 89.1 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 186.96328 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 186.96328 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 22.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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