5-Acetyl-2-bromopyridine - CAS 139042-59-4
Catalog: |
BB008878 |
Product Name: |
5-Acetyl-2-bromopyridine |
CAS: |
139042-59-4 |
Synonyms: |
1-(6-bromopyridin-3-yl)ethanone |
IUPAC Name: | 1-(6-bromopyridin-3-yl)ethanone |
Description: | 5-Acetyl-2-bromopyridine (CAS# 139042-59-4) is a useful research chemical. |
Molecular Weight: | 200.03 |
Molecular Formula: | C7H6BrNO |
Canonical SMILES: | CC(=O)C1=CN=C(C=C1)Br |
InChI: | InChI=1S/C7H6BrNO/c1-5(10)6-2-3-7(8)9-4-6/h2-4H,1H3 |
InChI Key: | MUKKGHQBUKOMTD-UHFFFAOYSA-N |
Boiling Point: | 304.7 °C at 760 mmHg |
Purity: | 98 % |
Density: | 1.534 g/cm3 |
MDL: | MFCD04974527 |
LogP: | 2.04670 |
GHS Hazard Statement: | H315 (89.36%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021133831-A1 | Compositions for use for the inhibition of dihydroorotate dehydrogenase | 20191226 |
CN-110746406-A | 3, 4-diazafluorenone derivatives, method for synthesizing the same, and electronic device containing the 3, 4-diazafluorenone derivatives | 20191119 |
WO-2021097139-A1 | Chiral synthesis of a tertiary alcohol | 20191115 |
WO-2021067606-A1 | Brm targeting compounds and associated methods of use | 20191001 |
WO-2021055612-A1 | Substituted imidazole carboxamides and their use in the treatment of medical disorders | 20190917 |
Complexity: | 138 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 198.96328 |
Formal Charge: | 0 |
Heavy Atom Count: | 10 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 198.96328 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 30 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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