| CAS Number | 549889-66-9 |
| Catalog Number | AG01E726(AGN-PC-0AM6KI) |
| Chemical Name | (5-methylfuran-3-yl)methanamine |
| IUPAC Name | (5-methylfuran-3-yl)methanamine |
| InChI | InChI=1S/C6H9NO/c1-5-2-6(3-7)4-8-5/h2,4H,3,7H2,1H3 |
| InChI Key | JCEWFVSQKKVQDD-UHFFFAOYSA-N |
| MDL Number | MFCD19207554 |
| Molecular Formula | C6H9NO |
| Molecular Weight | 111.1418 |
| SMILES | CC1OC=C(CN)C=1 |
| Synonyms | (5-methylfuran-3-yl)methanamine,
549889-66-9,
3-Furanmethanamine, 5-methyl-,
2-Methyl-4-(aminomethyl)furan,
SCHEMBL20045076,
AKOS006360337,
|
| Complexity | 74.9 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 111.068g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 111.144g/mol |
| Monoisotopic Mass | 111.068g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 39.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number