4-Bromoisoxazole - CAS 97925-43-4
Catalog: |
BB042078 |
Product Name: |
4-Bromoisoxazole |
CAS: |
97925-43-4 |
Synonyms: |
4-bromoisoxazole; 4-bromo-1,2-oxazole |
IUPAC Name: | 4-bromo-1,2-oxazole |
Description: | 4-Bromoisoxazole (CAS# 97925-43-4) is a useful research chemical. |
Molecular Weight: | 147.96 |
Molecular Formula: | C3H2BrNO |
Canonical SMILES: | C1=C(C=NO1)Br |
InChI: | InChI=1S/C3H2BrNO/c4-3-1-5-6-2-3/h1-2H |
InChI Key: | IRDVIGFQMLUJAM-UHFFFAOYSA-N |
Boiling Point: | 182.7 °C at 760 mmHg |
Density: | 1.812 g/cm3 |
Appearance: | Solid |
Storage: | Keep in dark place, Sealed in dry, 2-8 °C |
MDL: | MFCD02179569 |
LogP: | 1.43710 |
GHS Hazard Statement: | H302 (95.12%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P301+P312, P330, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021087127-A1 | Cannabinoids and uses thereof | 20191029 |
WO-2021032209-A1 | Anti-influenza virus compound, preparation method and use thereof | 20190822 |
WO-2020104822-A1 | Compounds | 20181123 |
CN-113056305-A | Compound (I) | 20181123 |
EP-3883650-A1 | Compounds | 20181123 |
Complexity: | 50.1 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 146.93198 |
Formal Charge: | 0 |
Heavy Atom Count: | 6 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 146.93198 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 26 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.1 |
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