| CAS Number | 1178819-40-3 |
| Catalog Number | AG0097H4(AGN-PC-0WNMVA) |
| Chemical Name | (2,2-difluoroethyl)(prop-2-en-1-yl)amine |
| IUPAC Name | N-(2,2-difluoroethyl)prop-2-en-1-amine |
| InChI | InChI=1S/C5H9F2N/c1-2-3-8-4-5(6)7/h2,5,8H,1,3-4H2 |
| InChI Key | GIGQBFJJTYMGIW-UHFFFAOYSA-N |
| MDL Number | MFCD12807379 |
| Molecular Formula | C5H9F2N |
| Molecular Weight | 121.1285 |
| SMILES | FC(F)CNCC=C |
| Synonyms | N-(2,2-difluoroethyl)prop-2-en-1-amine,
1178819-40-3,
SCHEMBL3712091,
GIGQBFJJTYMGIW-UHFFFAOYSA-N,
MFCD12807379,
AKOS010146456,
CS-0059708,
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| Complexity | 63.4 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 121.07g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 8 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 121.131g/mol |
| Monoisotopic Mass | 121.07g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 12A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
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Certificate of Analysis
Lot Number