| CAS Number | 1554866-90-8 |
| Catalog Number | AG01C0DZ |
| Chemical Name | methoxy[(5-methylfuran-2-yl)methyl]amine |
| IUPAC Name | N-methoxy-1-(5-methylfuran-2-yl)methanamine |
| InChI | InChI=1S/C7H11NO2/c1-6-3-4-7(10-6)5-8-9-2/h3-4,8H,5H2,1-2H3 |
| InChI Key | SXKCOMWMJSUKDF-UHFFFAOYSA-N |
| MDL Number | MFCD24288874 |
| Molecular Formula | C7H11NO2 |
| Molecular Weight | 141.1677 |
| SMILES | CONCC1OC(C)=CC=1 |
| Synonyms | methoxy[(5-methylfuran-2-yl)methyl]amine,
1554866-90-8,
ZINC75067526,
AKOS021023979,
|
| Complexity | 97.6 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 141.079g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 141.17g/mol |
| Monoisotopic Mass | 141.079g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 34.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number