| CAS Number | 1447944-38-8 |
| Catalog Number | AG01C4V6 |
| Chemical Name | 1-(1,1-Difluoroethyl)cyclopropane-1-carboxylic acid |
| IUPAC Name | 1-(1,1-difluoroethyl)cyclopropane-1-carboxylic acid |
| InChI | InChI=1S/C6H8F2O2/c1-5(7,8)6(2-3-6)4(9)10/h2-3H2,1H3,(H,9,10) |
| InChI Key | AXZPPINNVGZENV-UHFFFAOYSA-N |
| MDL Number | MFCD28361842 |
| Molecular Formula | C6H8F2O2 |
| Molecular Weight | 150.1233 |
| SMILES | CC(C1(C(O)=O)CC1)(F)F |
| Synonyms | 1447944-38-8,
1-(1,1-difluoroethyl)cyclopropane-1-carboxylic acid,
Cyclopropanecarboxylic acid, 1-(1,1-difluoroethyl)-,
SCHEMBL15114683,
AKOS024049459,
ZINC211848353,
Z2489418713,
|
| Complexity | 173 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 150.049g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 150.125g/mol |
| Monoisotopic Mass | 150.049g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 37.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
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