CAS
170642-28-1 Purity
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170642-28-1 Purity
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Specification
The molecular formula is C6H14O.
The molecular weight is 102.17 g/mol.
The IUPAC name is (2R)-2-methylpentan-1-ol.
The InChI is InChI=1S/C6H14O/c1-3-4-6(2)5-7/h6-7H,3-5H2,1-2H3/t6-/m1/s1.
The InChIKey is PFNHSEQQEPMLNI-ZCFIWIBFSA-N.
The canonical SMILES is CCCC(C)CO.
Some of the synonyms are (2R)-2-methylpentan-1-ol, (R)-2-METHYLPENTANOL, and 17092-41-0.
It has 1 hydrogen bond donor count.
It has 3 rotatable bond counts.
Yes, it is a canonicalized compound.