| CAS Number | 1221722-79-7 |
| Catalog Number | AG01A8B1(AGN-PC-0WO7UK) |
| Chemical Name | [(4,5-dibromofuran-2-yl)methyl](methyl)amine |
| IUPAC Name | 1-(4,5-dibromofuran-2-yl)-N-methylmethanamine |
| InChI | InChI=1S/C6H7Br2NO/c1-9-3-4-2-5(7)6(8)10-4/h2,9H,3H2,1H3 |
| InChI Key | IRVFJNNPAZHTHM-UHFFFAOYSA-N |
| MDL Number | MFCD15209686 |
| Molecular Formula | C6H7Br2NO |
| Molecular Weight | 268.9339 |
| SMILES | CNCC1OC(Br)=C(Br)C=1 |
| Synonyms | [(4,5-dibromofuran-2-yl)methyl](methyl)amine,
1221722-79-7,
AC1Q414K,
ZINC47843892,
AKOS011363035,
NE50580,
EN300-61202,
|
| Complexity | 112 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 268.887g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 268.936g/mol |
| Monoisotopic Mass | 266.889g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 25.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
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Certificate of Analysis
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