CAS
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Specification
The molecular formula is C9H14O.
The structure was created on 2007-12-04 and last modified on 2023-11-25.
The molecular weight is 138.21 g/mol.
The IUPAC name is 1-but-1-ynylcyclopentan-1-ol.
The Canonical SMILES is CCC#CC1(CCCC1)O.
The InChIKey is MUYNZFHFJRJANX-UHFFFAOYSA-N.
It has 1 hydrogen bond donor count.
The topological polar surface area is 20.2Ų.
Yes, the compound is canonicalized.
It has 1 rotatable bond count.