| CAS Number | 1306604-69-2 |
| Catalog Number | AG01AIBQ |
| Chemical Name | (2,5-dimethylfuran-3-yl)methanamine hydrochloride |
| IUPAC Name | (2,5-dimethylfuran-3-yl)methanamine;hydrochloride |
| InChI | InChI=1S/C7H11NO.ClH/c1-5-3-7(4-8)6(2)9-5;/h3H,4,8H2,1-2H3;1H |
| InChI Key | GIWAAZTWCWKTQB-UHFFFAOYSA-N |
| MDL Number | MFCD18838990 |
| Molecular Formula | C7H12ClNO |
| Molecular Weight | 161.6293 |
| SMILES | Cl.CC1OC(C)=C(CN)C=1 |
| Synonyms | (2,5-dimethylfuran-3-yl)methanamine hydrochloride,
1306604-69-2,
AKOS026744824,
NE50391,
EN300-77340,
|
| Complexity | 94.9 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 161.061g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 161.629g/mol |
| Monoisotopic Mass | 161.061g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 39.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number