2-Chloro-4-fluorobenzoyl chloride - CAS 21900-54-9
Catalog: |
BB017193 |
Product Name: |
2-Chloro-4-fluorobenzoyl chloride |
CAS: |
21900-54-9 |
Synonyms: |
2-chloro-4-fluorobenzoyl chloride |
IUPAC Name: | 2-chloro-4-fluorobenzoyl chloride |
Description: | 2-Chloro-4-fluorobenzoyl chloride (CAS# 21900-54-9) is a useful research chemical. |
Molecular Weight: | 193.00 |
Molecular Formula: | C7H3Cl2FO |
Canonical SMILES: | C1=CC(=C(C=C1F)Cl)C(=O)Cl |
InChI: | InChI=1S/C7H3Cl2FO/c8-6-3-4(10)1-2-5(6)7(9)11/h1-3H |
InChI Key: | POIAZJJVWRVLBO-UHFFFAOYSA-N |
Boiling Point: | 98-102 °C (15 mmHg) |
Purity: | 96.0 % (GC) |
Density: | 1.447 g/mL at 25 °C |
Appearance: | Clear pale yellow to yellow liquid |
MDL: | MFCD00084954 |
LogP: | 2.85810 |
GHS Hazard Statement: | H302 (86.67%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P260, P264, P270, P280, P301+P312, P301+P330+P331, P303+P361+P353, P304+P340, P305+P351+P338, P310, P321, P330, P363, P405, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-113087713-A | Benzodiazepine derivatives, and preparation method and use thereof | 20210329 |
CN-110218193-A | 3- hydroxyquinazoline -2,4 (1H, 3H)-diketone derivative and the preparation method and application thereof | 20190708 |
WO-2020169682-A1 | Hydrazide derivatives and their specific use as antibacterial agents by controlling acinetobacter baumannii bacterium | 20190219 |
JP-2020109086-A | Pharmaceutical composition | 20181228 |
JP-2021102653-A | Pharmaceutical composition | 20181228 |
PMID | Publication Date | Title | Journal |
21583467 | 20090704 | 2-Chloro-4-fluoro-N-phenyl-benzamide | Acta crystallographica. Section E, Structure reports online |
Complexity: | 163 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 191.9544983 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 191.9544983 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 17.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.3 |
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