| CAS Number | 1256822-16-8 |
| Catalog Number | AG000OG5(AGN-PC-0WO5DA) |
| Chemical Name | 4-Pyridinecarbonitrile, 2-bromo-5-fluoro- |
| 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 |
| MDL Number | MFCD18258644 |
| Molecular Formula | C6H2BrFN2 |
| Molecular Weight | 200.9959 |
| SMILES | N#CC1=C(F)C=NC(Br)=C1 |
| Synonyms | 1256822-16-8,
2-Bromo-5-fluoroisonicotinonitrile,
2-bromo-5-fluoropyridine-4-carbonitrile,
4-Pyridinecarbonitrile, 2-bromo-5-fluoro-,
SCHEMBL16375109,
KS-000008JD,
MFCD18258644,
ZINC95942492,
AKOS026727845,
FCH1366092,
NE44298,
SB21470,
AS-53977,
CS-0051994,
EN300-159671,
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| Complexity | 164 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 199.939g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 200.998g/mol |
| Monoisotopic Mass | 199.939g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 36.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H302-H312-H315-H319-H332-H335
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Packing Group
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Precautionary statements
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P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P305+P351+P338-P330-P332+P313-P337+P313-P362-P403+P233-P405-P501
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UN Code
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Certificate of Analysis
Lot Number