| CAS Number | 86770-82-3 |
| Catalog Number | AG00IE7B(AGN-PC-004C5E) |
| Chemical Name | Cyclobutanecarboxamide, 3,3-difluoro- |
| IUPAC Name | 3,3-difluorocyclobutane-1-carboxamide |
| InChI | InChI=1S/C5H7F2NO/c6-5(7)1-3(2-5)4(8)9/h3H,1-2H2,(H2,8,9) |
| InChI Key | VGWXCRGEZCMEJU-UHFFFAOYSA-N |
| MDL Number | MFCD15144539 |
| Molecular Formula | C5H7F2NO |
| Molecular Weight | 135.1120 |
| SMILES | NC(=O)C1CC(C1)(F)F |
| Synonyms | 3,3-difluorocyclobutanecarboxamide,
86770-82-3,
3,3-difluorocyclobutane-1-carboxamide,
SCHEMBL15540967,
VGWXCRGEZCMEJU-UHFFFAOYSA-N,
AKOS006360298,
Cyclobutanecarboxamide, 3,3-difluoro-,
Cyclobutanecarboxamide,3,3-difluoro-,
CID11205774,
Cyclobutanecarboxamide, 3,3-difluoro- (9CI),
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| Complexity | 138 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 135.04957g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 135.11g/mol |
| Monoisotopic Mass | 135.04957g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 43.1Ų |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.3 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
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