2-Cyano-5-fluoropyridine - CAS 327056-62-2
Catalog: |
BB021372 |
Product Name: |
2-Cyano-5-fluoropyridine |
CAS: |
327056-62-2 |
Synonyms: |
5-fluoropyridine-2-carbonitrile |
IUPAC Name: | 5-fluoropyridine-2-carbonitrile |
Description: | 2-Cyano-5-fluoropyridine (CAS# 327056-62-2) is a useful research chemical. |
Molecular Weight: | 122.10 |
Molecular Formula: | C6H3FN2 |
Canonical SMILES: | C1=CC(=NC=C1F)C#N |
InChI: | InChI=1S/C6H3FN2/c7-5-1-2-6(3-8)9-4-5/h1-2,4H |
InChI Key: | BHXHRMVSUUPOLX-UHFFFAOYSA-N |
Boiling Point: | 214.9 °C at 760 mmHg |
Melting Point: | 35-41 °C |
Purity: | 98 % |
Density: | 1.24 g/cm3 |
Appearance: | White to tan solid, powder, crystals, or chunks |
MDL: | MFCD08741371 |
LogP: | 1.09238 |
GHS Hazard Statement: | H302 (95.83%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P273, P280, P301+P312, P302+P352, P305+P351+P338, P310, P321, P330, P332+P313, P337+P313, P362, P391, and P501 |
Signal Word: | Danger |
Publication Number | Title | Priority Date |
CN-111302968-A | Synthesis method of amide nitrogen trifluoromethyl compound | 20200320 |
CN-111302968-B | Synthesis method of amide nitrogen trifluoromethyl compound | 20200320 |
WO-2021133915-A1 | Ectonucleotide pyrophosphatase/phosphodiesterase 1 (enpp1) modulators and uses thereof | 20191223 |
CN-112279845-A | Aryl or heteroaryl substituted thiadiazole compounds and antibacterial application thereof | 20190724 |
US-2021024492-A1 | Novel pyridazines | 20190722 |
Complexity: | 137 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 122.02802627 |
Formal Charge: | 0 |
Heavy Atom Count: | 9 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 122.02802627 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 36.7 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1 |
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