| CAS Number | 1203498-94-5 |
| Catalog Number | AG009M25(AGN-PC-0WANUR) |
| Chemical Name | 6-Bromofuro[3,2-b]pyridine-2-carbonitrile |
| IUPAC Name | 6-bromofuro[3,2-b]pyridine-2-carbonitrile |
| InChI | InChI=1S/C8H3BrN2O/c9-5-1-8-7(11-4-5)2-6(3-10)12-8/h1-2,4H |
| InChI Key | DCCFLNQLIYYNHQ-UHFFFAOYSA-N |
| MDL Number | MFCD13563100 |
| Molecular Formula | C8H3BrN2O |
| Molecular Weight | 223.0262 |
| SMILES | C1=C(OC2=CC(=CN=C21)Br)C#N |
| Synonyms | 6-Bromofuro[3,2-b]pyridine-2-carbonitrile,
1203498-94-5,
C8H3BrN2O,
AC1Q25B3,
CTK7C7414,
DTXSID70673644,
0871AD,
MFCD13563100,
ZINC39961371,
AKOS015834523,
AJ-101551,
TR-070690,
A-6178,
6-Bromofuro[3,2-b]pyridine-2-carbonitrile, AldrichCPR,
|
| Complexity | 224 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 221.943g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 223.029g/mol |
| Monoisotopic Mass | 221.943g/mol |
| Rotatable Bond Count | 0 |
| Topological Polar Surface Area | 49.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
| Symbol: |  |
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Hazard statements
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H302
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Precautionary statements
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Certificate of Analysis
Lot Number