| CAS Number | 59563-51-8 |
| Catalog Number | AG019K6T(AGN-PC-0OCXS4) |
| Chemical Name | 2-(2-Bromoethenyl)-5-nitrofuran |
| IUPAC Name | 2-(2-bromoethenyl)-5-nitrofuran |
| InChI | InChI=1S/C6H4BrNO3/c7-4-3-5-1-2-6(11-5)8(9)10/h1-4H |
| InChI Key | DWHDJUJHFAUWFM-UHFFFAOYSA-N |
| MDL Number | MFCD00098944 |
| Molecular Formula | C6H4BrNO3 |
| Molecular Weight | 218.0049 |
| SMILES | [O-][N+](=O)c1ccc(o1)C=CBr |
| Synonyms | 2-(2-Bromoethenyl)-5-nitrofuran,
67363-72-8,
59563-51-8,
AC1L3SL0,
CTK2F3632,
CTK8F3943,
2-(2-bromoethenyl)-5-nitro-furan,
AKOS033798803,
MCULE-7521500045,
Z220356546,
2-[2-bromovinyl]-5-nitrofuran,
CID94622,
NSC291062,
|
| Complexity | 177 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 216.937g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 218.006g/mol |
| Monoisotopic Mass | 216.937g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 59A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 1 |
| XLogP3 | 2.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number