2-Bromo-5-fluorophenol - CAS 147460-41-1
Catalog: |
BB010199 |
Product Name: |
2-Bromo-5-fluorophenol |
CAS: |
147460-41-1 |
Synonyms: |
Phenol, 2-bromo-5-fluoro- |
IUPAC Name: | 2-bromo-5-fluorophenol |
Molecular Weight: | 191.00 |
Molecular Formula: | C6H4BrFO |
Canonical SMILES: | C1=CC(=C(C=C1F)O)Br |
InChI: | InChI=1S/C6H4BrFO/c7-5-2-1-4(8)3-6(5)9/h1-3,9H |
InChI Key: | HUVAOAVBKOVPBZ-UHFFFAOYSA-N |
Boiling Point: | 194.6±20.0°C at 760 mmHg |
Melting Point: | 185 ℃ |
Purity: | 95% |
Density: | 1.764±0.06 g/cm3 |
Appearance: | Clear Colorless to Light Yellow Liquid |
Storage: | Store at RT |
MDL: | MFCD00040939 |
LogP: | 2.29380 |
GHS Hazard Statement: | H302 (14.58%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021106230-A1 | Novel phenol compound or salt thereof | 20191129 |
WO-2021108023-A1 | Penicillin-binding protein inhibitors | 20191126 |
WO-2021032074-A1 | Benzamide fused aromatic ring derivative, preparation method therefor and application thereof in medicine | 20190819 |
CN-112390745-A | Pyridine nicotinamide derivatives, preparation method and medical application thereof | 20190819 |
WO-2021018165-A1 | Pyridine benzamide derivative, preparation method for same, and medicinal applications thereof | 20190730 |
Complexity: | 99.1 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 189.94296 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 189.94296 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 20.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.6 |
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