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Specification
The molecular formula of (S)-3-Methylnonanoic acid is C10H20O2.
The molecular weight of (S)-3-Methylnonanoic acid is 172.26 g/mol.
The IUPAC name of (S)-3-Methylnonanoic acid is 3-methylnonanoic acid.
The InChIKey of (S)-3-Methylnonanoic acid is ZDIXEQISPGRDEB-UHFFFAOYSA-N.
The canonical SMILES of (S)-3-Methylnonanoic acid is CCCCCCC(C)CC(=O)O.
The CAS number of (S)-3-Methylnonanoic acid is 35205-79-9.
The XLogP3-AA value of (S)-3-Methylnonanoic acid is 3.8.
There is 1 hydrogen bond donor count in (S)-3-Methylnonanoic acid.
There are 2 hydrogen bond acceptor counts in (S)-3-Methylnonanoic acid.
There are 7 rotatable bond counts in (S)-3-Methylnonanoic acid.