| CAS Number | 1780621-63-7 |
| Catalog Number | AG01BCVL(AGN-PC-0WOTW6) |
| Chemical Name | 3-(difluoromethoxy)butan-1-amine |
| IUPAC Name | 3-(difluoromethoxy)butan-1-amine |
| InChI | InChI=1S/C5H11F2NO/c1-4(2-3-8)9-5(6)7/h4-5H,2-3,8H2,1H3 |
| InChI Key | HMFRATILFYXVAY-UHFFFAOYSA-N |
| MDL Number | MFCD28012326 |
| Molecular Formula | C5H11F2NO |
| Molecular Weight | 139.1437 |
| SMILES | CC(OC(F)F)CCN |
| Synonyms | 3-(difluoromethoxy)butan-1-amine,
1780621-63-7,
AKOS024124519,
|
| Complexity | 70 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 139.081g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 139.146g/mol |
| Monoisotopic Mass | 139.081g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number