813-99-0 Purity
---
If you have any other questions or need other size, please get a quote.
Specification
The molecular formula of 4-Methyl-1-hexanol is C7H16O.
The molecular weight of 4-Methyl-1-hexanol is 116.20 g/mol.
The IUPAC name of 4-Methyl-1-hexanol is 4-methylhexan-1-ol.
The InChI of 4-Methyl-1-hexanol is InChI=1S/C7H16O/c1-3-7(2)5-4-6-8/h7-8H,3-6H2,1-2H3.
The InChIKey of 4-Methyl-1-hexanol is YNPVNLWKVZZBTM-UHFFFAOYSA-N.
The canonical SMILES of 4-Methyl-1-hexanol is CCC(C)CCCO.
The CAS number of 4-Methyl-1-hexanol is 818-49-5.
The XLogP3-AA value of 4-Methyl-1-hexanol is 2.1.
4-Methyl-1-hexanol has 4 rotatable bonds.
Yes, 4-Methyl-1-hexanol is a canonicalized compound according to PubChem.