| CAS Number | 139914-16-2 |
| Catalog Number | AG01A4G9(AGN-PC-0HGV87) |
| Chemical Name | 6,7-Dibromo-2-naphthonitrile |
| IUPAC Name | 6,7-dibromonaphthalene-2-carbonitrile |
| InChI | InChI=1S/C11H5Br2N/c12-10-4-8-2-1-7(6-14)3-9(8)5-11(10)13/h1-5H |
| InChI Key | AXIPOXSIDGLBTH-UHFFFAOYSA-N |
| MDL Number | MFCD12024916 |
| Molecular Formula | C11H5Br2N |
| Molecular Weight | 310.9721 |
| SMILES | BrC1=C(Br)C=C2C(C=CC(=C2)C#N)=C1 |
| Synonyms | 6,7-Dibromo-2-naphthonitrile,
139914-16-2,
6,7-dibromonaphthalene-2-carbonitrile,
2-Naphthalenecarbonitrile, 6,7-dibromo-,
C11H5Br2N,
SCHEMBL2694188,
DTXSID00737389,
6806AA,
ZINC90225723,
6,7-Dibromo-2-naphthalenecarbonitrile,
AKOS016011000,
FCH1409086,
NE49854,
AJ-128548,
AX8245367,
EN300-125539,
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| Complexity | 257 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 310.877g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 310.976g/mol |
| Monoisotopic Mass | 308.879g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 23.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 4.3 |
GHS Hazard and Precautionary Statements
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Hazard Class
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Hazard statements
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H317-H319
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Packing Group
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Precautionary statements
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P280-P305+P351+P338
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UN Code
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Certificate of Analysis
Lot Number