| CAS Number | 1092298-70-8 |
| Catalog Number | AG01C27S |
| Chemical Name | 2-[(2-Methylbutan-2-yl)oxy]acetic acid |
| IUPAC Name | 2-(2-methylbutan-2-yloxy)acetic acid |
| InChI | InChI=1S/C7H14O3/c1-4-7(2,3)10-5-6(8)9/h4-5H2,1-3H3,(H,8,9) |
| InChI Key | ULAAVKXNQXUALP-UHFFFAOYSA-N |
| MDL Number | MFCD10691028 |
| Molecular Formula | C7H14O3 |
| Molecular Weight | 146.1843 |
| SMILES | CCC(OCC(O)=O)(C)C |
| Synonyms | 2-[(2-methylbutan-2-yl)oxy]acetic acid,
1092298-70-8,
SCHEMBL2560726,
ZINC26515409,
AKOS009256375,
Z2284433473,
acetic acid, 2-(1,1-dimethylpropoxy)-,
|
| Complexity | 118 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 146.094g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 10 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 146.186g/mol |
| Monoisotopic Mass | 146.094g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 46.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number