| CAS Number | 457938-24-8 |
| Catalog Number | AG00DASW(AGN-PC-0WB4SH) |
| Chemical Name | N-Allyl-5-bromo-2-furamide |
| IUPAC Name | 5-bromo-N-prop-2-enylfuran-2-carboxamide |
| InChI | InChI=1S/C8H8BrNO2/c1-2-5-10-8(11)6-3-4-7(9)12-6/h2-4H,1,5H2,(H,10,11) |
| InChI Key | YCYWEEWJVDCIJV-UHFFFAOYSA-N |
| MDL Number | MFCD01408993 |
| Molecular Formula | C8H8BrNO2 |
| Molecular Weight | 230.0586 |
| SMILES | C1(=CC=C(Br)O1)C(NCC=C)=O |
| Synonyms | N-ALLYL-5-BROMO-2-FURAMIDE,
457938-24-8,
N-Allyl-5-bromofuran-2-carboxamide,
CHEMBRDG-BB 7317301,
AC1MOI9I,
CTK4I8955,
DTXSID80391645,
ZINC5382774,
MFCD01408993,
AKOS002953105,
MCULE-6905774009,
AJ-53945,
5-bromo-N-prop-2-enylfuran-2-carboxamide,
W-8263,
CID3344054,
5-bromo-N-prop-2-enyl-furan-2-carboxamide,
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| Complexity | 184 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 228.974g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 230.061g/mol |
| Monoisotopic Mass | 228.974g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 42.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number