80866-88-2 Purity
96%
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Specification
The molecular formula of 3-Ethyl-2,2-dimethyl-3-pentanol is C9H20O.
The molecular weight of 3-Ethyl-2,2-dimethyl-3-pentanol is 144.25 g/mol.
The IUPAC name of 3-Ethyl-2,2-dimethyl-3-pentanol is 3-ethyl-2,2-dimethylpentan-3-ol.
The InChI of 3-Ethyl-2,2-dimethyl-3-pentanol is InChI=1S/C9H20O/c1-6-9(10,7-2)8(3,4)5/h10H,6-7H2,1-5H3.
The InChIKey of 3-Ethyl-2,2-dimethyl-3-pentanol is CFWIFHZJKFFDFU-UHFFFAOYSA-N.
The canonical SMILES of 3-Ethyl-2,2-dimethyl-3-pentanol is CCC(CC)(C(C)(C)C)O.
The CAS number of 3-Ethyl-2,2-dimethyl-3-pentanol is 66793-96-2.
The EC number of 3-Ethyl-2,2-dimethyl-3-pentanol is 623-542-5.
The XLogP3-AA value of 3-Ethyl-2,2-dimethyl-3-pentanol is 2.9.
Yes, 3-Ethyl-2,2-dimethyl-3-pentanol is a canonicalized compound.