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2-bromo-5-fluoropyridine-4-carbonitrile - 97%, high purity , CAS No.1256822-16-8
Basic Description
Synonyms | 2-Bromo-5-fluoroisonicotinonitrile | 4-Pyridinecarbonitrile, 2-bromo-5-fluoro- | SCHEMBL16375109 | P17360 | DTXSID301279934 | AS-53977 | A935160 | 2-Bromo-5-fluoro-4-pyridinecarbonitrile | SY047795 | CS-0051994 | AKOS026727845 | 1256822-16-8 | 2-bromo-5-f |
Specifications & Purity | ≥97% |
Shipped In | Normal |
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Names and Identifiers
IUPAC Name | 2-bromo-5-fluoropyridine-4-carbonitrile |
INCHI | InChI=1S/C6H2BrFN2/c7-6-1-4(2-9)5(8)3-10-6/h1,3H |
InChi Key | GLUXDIYRUHBWMX-UHFFFAOYSA-N |
Canonical SMILES | C1=C(C(=CN=C1Br)F)C#N |
Isomeric SMILES | C1=C(C(=CN=C1Br)F)C#N |
Alternate CAS | 1256822-16-8 |
PubChem CID | 75481745 |
Molecular Weight | 201 |
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Certificates(CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
Molecular Weight | 201.000 g/mol |
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XLogP3 | 1.700 |
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Hydrogen Bond Donor Count | 0 |
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Hydrogen Bond Acceptor Count | 3 |
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Rotatable Bond Count | 0 |
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Exact Mass | 199.939 Da |
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Monoisotopic Mass | 199.939 Da |
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Topological Polar Surface Area | 36.700 Ų |
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Heavy Atom Count | 10 |
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Formal Charge | 0 |
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Complexity | 164.000 |
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Isotope Atom Count | 0 |
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Defined Atom Stereocenter Count | 0 |
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Undefined Atom Stereocenter Count | 0 |
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Defined Bond Stereocenter Count | 0 |
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Undefined Bond Stereocenter Count | 0 |
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The total count of all stereochemical bonds | 0 |
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Covalently-Bonded Unit Count | 1 |
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Safety and Hazards(GHS)
Pictogram(s) | GHS07 |
Signal | Warning |
Hazard Statements | H315:Causes skin irritation H319:Causes serious eye irritation H302:Harmful if swallowed |
Precautionary Statements | P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses if present and easy to do - continue rinsing. P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of water. P321:Specific treatment (see ... on this label). P501:Dispose of contents/container to ... P264:Wash hands [and …] thoroughly after handling. P362:Take off contaminated clothing. P270:Do not eat, drink or smoke when using this product. P337+P313:IF eye irritation persists: Get medical advice/attention. P332+P313:IF SKIN irritation occurs: Get medical advice/attention. P330:Rinse mouth. P301+P312:IF SWALLOWED: call a POISON CENTER/doctor/... IF you feel unwell. |
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