4-ethyl-3,3-dimethylcyclohexan-1-ol

C10H20O — CID 58534383

IUPAC4-ethyl-3,3-dimethylcyclohexan-1-ol
SMILESCCC1CCC(O)CC1(C)C
InChIInChI=1S/C10H20O/c1-4-8-5-6-9(11)7-10(8,2)3/h8-9,11H,4-7H2,1-3H3
InChIKeyLLZWVLGGLWOCLJ-UHFFFAOYSA-N
MW156.27 g/mol
LogP2.58
Rot. Bonds1

About 4-ethyl-3,3-dimethylcyclohexan-1-ol

4-ethyl-3,3-dimethylcyclohexan-1-ol (PubChem CID 58534383) has the molecular formula C10H20O and a molecular weight of 156.27 g/mol. Its IUPAC name is 4-ethyl-3,3-dimethylcyclohexan-1-ol.

Molecular Properties

Compound Name4-ethyl-3,3-dimethylcyclohexan-1-ol
PubChem CID58534383
Molecular FormulaC10H20O
Molecular Weight156.27 g/mol
Exact Mass156.15
IUPAC Name4-ethyl-3,3-dimethylcyclohexan-1-ol
SMILESCCC1CCC(O)CC1(C)C
InChIInChI=1S/C10H20O/c1-4-8-5-6-9(11)7-10(8,2)3/h8-9,11H,4-7H2,1-3H3
InChIKeyLLZWVLGGLWOCLJ-UHFFFAOYSA-N
XLogP2.58
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-3,3-dimethylcyclohexan-1-ol?
The IUPAC name of 4-ethyl-3,3-dimethylcyclohexan-1-ol (CID 58534383) is 4-ethyl-3,3-dimethylcyclohexan-1-ol.
What is the SMILES notation for 4-ethyl-3,3-dimethylcyclohexan-1-ol?
The canonical SMILES for 4-ethyl-3,3-dimethylcyclohexan-1-ol is CCC1CCC(O)CC1(C)C.
What is the InChIKey of 4-ethyl-3,3-dimethylcyclohexan-1-ol?
The InChIKey is LLZWVLGGLWOCLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O/c1-4-8-5-6-9(11)7-10(8,2)3/h8-9,11H,4-7H2,1-3H3.
What are the key properties of 4-ethyl-3,3-dimethylcyclohexan-1-ol?
4-ethyl-3,3-dimethylcyclohexan-1-ol has a molecular weight of 156.27 g/mol, XLogP of 2.58, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-3,3-dimethylcyclohexan-1-ol is sourced from PubChem (CID 58534383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).