3-Bromo-4-methylpyridin-2(1H)-one - CAS 18368-59-7
Catalog: |
BB014083 |
Product Name: |
3-Bromo-4-methylpyridin-2(1H)-one |
CAS: |
18368-59-7 |
Synonyms: |
3-bromo-4-methyl-1H-pyridin-2-one; 3-bromo-4-methyl-1H-pyridin-2-one |
IUPAC Name: | 3-bromo-4-methyl-1H-pyridin-2-one |
Description: | 3-Bromo-4-methylpyridin-2(1H)-one (CAS# 18368-59-7) is a useful research chemical. |
Molecular Weight: | 188.02 |
Molecular Formula: | C6H6BrNO |
Canonical SMILES: | CC1=C(C(=O)NC=C1)Br |
InChI: | InChI=1S/C6H6BrNO/c1-4-2-3-8-6(9)5(4)7/h2-3H,1H3,(H,8,9) |
InChI Key: | DDRFLSCTQJTMAA-UHFFFAOYSA-N |
Boiling Point: | 323.221 °C at 760 mmHg |
Density: | 1.622 g/cm3 |
LogP: | 1.44580 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation] |
Precautionary Statement: | P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2020002089-A1 | Substituted 2-heteroaryloxypyridines and salts thereof and their use as herbicidal agents | 20180625 |
AU-2019294743-A1 | Substituted 2-heteroaryloxypyridines and salts thereof and their use as herbicidal agents | 20180625 |
BR-112020025919-A2 | 2-REPLACED HETEROARYL OXYPYRIDINES AND THEIR SALTS AND THEIR USE AS HERBICIDAL AGENTS | 20180625 |
CA-3105217-A1 | Substituted 2-heteroaryloxypyridines and salts thereof and their use as herbicidal agents | 20180625 |
CN-112469712-A | Substituted 2-heteroaryloxypyridines and their salts and their use as herbicides | 20180625 |
Complexity: | 205 |
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: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 186.96328 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 29.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1 |
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