CAS
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Specification
The molecular formula is C8H18O.
The molecular weight is 130.23 g/mol.
The IUPAC name is 2,4,4-trimethylpentan-1-ol.
The InChI is InChI=1S/C8H18O/c1-7(6-9)5-8(2,3)4/h7,9H,5-6H2,1-4H3.
The InChIKey is ZNRVRWHPZZOTIE-UHFFFAOYSA-N.
The Canonical SMILES is CC(CC(C)(C)C)CO.
The CAS number is 16325-63-6.
The European Community (EC) number is 240-403-0.
It has 1 hydrogen bond donor count.
It has 3 rotatable bond counts.