| CAS Number | 1517761-58-8 |
| Catalog Number | AG01DVI2 |
| Chemical Name | Methyl 2-Cyclobutyl-2-hydroxyacetate |
| IUPAC Name | methyl 2-cyclobutyl-2-hydroxyacetate |
| InChI | InChI=1S/C7H12O3/c1-10-7(9)6(8)5-3-2-4-5/h5-6,8H,2-4H2,1H3 |
| InChI Key | SLHBAAQBWSDPLW-UHFFFAOYSA-N |
| MDL Number | MFCD23914423 |
| Molecular Formula | C7H12O3 |
| Molecular Weight | 144.1684 |
| SMILES | COC(C(C1CCC1)O)=O |
| Synonyms | methyl 2-cyclobutyl-2-hydroxyacetate,
1517761-58-8,
AKOS019052053,
|
| Complexity | 129 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 144.079g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 144.17g/mol |
| Monoisotopic Mass | 144.079g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 46.5A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number