4-Chloro-2-fluorophenol - CAS 348-62-9
Catalog: |
BB022338 |
Product Name: |
4-Chloro-2-fluorophenol |
CAS: |
348-62-9 |
Synonyms: |
4-chloro-2-fluorophenol |
IUPAC Name: | 4-chloro-2-fluorophenol |
Description: | 4-Chloro-2-fluorophenol (CAS# 348-62-9) is a useful research compound. |
Molecular Weight: | 146.55 |
Molecular Formula: | C6H4ClFO |
Canonical SMILES: | C1=CC(=C(C=C1Cl)F)O |
InChI: | InChI=1S/C6H4ClFO/c7-4-1-2-6(9)5(8)3-4/h1-3,9H |
InChI Key: | ZKMUKBBWORLNLA-UHFFFAOYSA-N |
Boiling Point: | 103-104 °C (50 mmHg) |
Melting Point: | 20 °C |
Purity: | 98 % |
Density: | 1.378 g/cm3 |
Appearance: | Clear colorless to light yellow liquid |
MDL: | MFCD00075030 |
LogP: | 2.18470 |
GHS Hazard Statement: | H315 (100%): 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 |
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PMID | Publication Date | Title | Journal |
21793595 | 20110908 | Hydrogen-atom tunneling in isomerization around the C-O bond of 2-chloro-6-fluorophenol in low-temperature argon matrixes | The journal of physical chemistry. A |
17000040 | 20070201 | Sequestration of a fluorinated analog of 2,4-dichlorophenol and metabolic products by L. minor as evidenced by 19F NMR | Environmental pollution (Barking, Essex : 1987) |
Complexity: | 99.1 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 145.9934706 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 145.9934706 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 20.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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