| CAS Number | 1599344-15-6 |
| Catalog Number | AG01BGG3(AGN-PC-0WD8AA) |
| Chemical Name | 2-(Difluoromethoxy)ethan-1-amine |
| IUPAC Name | 2-(difluoromethoxy)ethanamine |
| InChI | InChI=1S/C3H7F2NO/c4-3(5)7-2-1-6/h3H,1-2,6H2 |
| InChI Key | XVHQHDWOVYAABP-UHFFFAOYSA-N |
| MDL Number | MFCD28397342 |
| Molecular Formula | C3H7F2NO |
| Molecular Weight | 111.0906 |
| SMILES | C(COC(F)F)N |
| Synonyms | 2-(difluoromethoxy)ethan-1-amine,
1599344-15-6,
2-(Difluoromethoxy)ethylamine,
SCHEMBL17996233,
2-(Difluoromethoxy)ethane-1-amine,
ZINC164471093,
J3.538.259C,
|
| Complexity | 41.9 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 111.05g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 7 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 111.092g/mol |
| Monoisotopic Mass | 111.05g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 35.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.1 |
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Certificate of Analysis
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