77158-86-2 Purity
96%
If you have any other questions or need other size, please get a quote.
Specification
The molecular formula of 3-Hydroxy-3-methylpentanoic acid is C6H12O3.
The molecular weight of 3-Hydroxy-3-methylpentanoic acid is 132.16 g/mol.
The IUPAC name of 3-Hydroxy-3-methylpentanoic acid is computed as 3-hydroxy-3-methylpentanoic acid.
The InChI of 3-Hydroxy-3-methylpentanoic acid is InChI=1S/C6H12O3/c1-3-6(2,9)4-5(7)8/h9H,3-4H2,1-2H3,(H,7,8).
The InChIKey of 3-Hydroxy-3-methylpentanoic acid is KEGHVPSZIWXTPY-UHFFFAOYSA-N.
The canonical SMILES of 3-Hydroxy-3-methylpentanoic acid is CCC(C)(CC(=O)O)O.
The CAS number of 3-Hydroxy-3-methylpentanoic acid is 150-96-9.
The European Community (EC) number of 3-Hydroxy-3-methylpentanoic acid is 679-928-9.
3-Hydroxy-3-methylpentanoic acid has 2 hydrogen bond donor counts.
3-Hydroxy-3-methylpentanoic acid has 3 rotatable bond counts.