329-56-6 Purity
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Specification
The molecular formula of 3,5,5-Trimethylhexanoic acid is C9H18O2.
3,5,5-Trimethylhexanoic acid was created on March 26, 2005.
The molecular weight of 3,5,5-Trimethylhexanoic acid is 158.24 g/mol.
The IUPAC name of 3,5,5-Trimethylhexanoic acid is 3,5,5-trimethylhexanoic acid.
The InChI key of 3,5,5-Trimethylhexanoic acid is OILUAKBAMVLXGF-UHFFFAOYSA-N.
The canonical SMILES of 3,5,5-Trimethylhexanoic acid is CC(CC(=O)O)CC(C)(C)C.
The CAS number of 3,5,5-Trimethylhexanoic acid is 3302-10-1.
3,5,5-Trimethylhexanoic acid has 1 hydrogen bond donor count.
3,5,5-Trimethylhexanoic acid has 4 rotatable bond counts.
The topological polar surface area of 3,5,5-Trimethylhexanoic acid is 37.3 ?2.