| CAS Number | 1082453-55-1 |
| Catalog Number | AG01AUKX |
| Chemical Name | 2-cyclobutylpropanoic acid |
| IUPAC Name | 2-cyclobutylpropanoic acid |
| InChI | InChI=1S/C7H12O2/c1-5(7(8)9)6-3-2-4-6/h5-6H,2-4H2,1H3,(H,8,9) |
| InChI Key | RHFMBAUXLFDCJS-UHFFFAOYSA-N |
| MDL Number | MFCD09908184 |
| Molecular Formula | C7H12O2 |
| Molecular Weight | 128.1690 |
| SMILES | O=C(C(C1CCC1)C)O |
| Synonyms | 2-Cyclobutylpropanoic acid,
1082453-55-1,
SCHEMBL1931826,
RHFMBAUXLFDCJS-UHFFFAOYSA-N,
AKOS006313357,
Z1198237996,
CYCLOBUTYLPROPIONIC ACID,
|
| Complexity | 116 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 128.084g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 9 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 128.171g/mol |
| Monoisotopic Mass | 128.084g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 37.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number