2-ethoxy-1,3-dimethylcyclohexane

C10H20O — CID 101096771

IUPAC2-ethoxy-1,3-dimethylcyclohexane
SMILESCCOC1C(C)CCCC1C
InChIInChI=1S/C10H20O/c1-4-11-10-8(2)6-5-7-9(10)3/h8-10H,4-7H2,1-3H3
InChIKeyHMKOSXMYMMZQQM-UHFFFAOYSA-N
MW156.27 g/mol
LogP2.85
Rot. Bonds2

About 2-ethoxy-1,3-dimethylcyclohexane

2-ethoxy-1,3-dimethylcyclohexane (PubChem CID 101096771) has the molecular formula C10H20O and a molecular weight of 156.27 g/mol. Its IUPAC name is 2-ethoxy-1,3-dimethylcyclohexane.

Molecular Properties

Compound Name2-ethoxy-1,3-dimethylcyclohexane
PubChem CID101096771
Molecular FormulaC10H20O
Molecular Weight156.27 g/mol
Exact Mass156.15
IUPAC Name2-ethoxy-1,3-dimethylcyclohexane
SMILESCCOC1C(C)CCCC1C
InChIInChI=1S/C10H20O/c1-4-11-10-8(2)6-5-7-9(10)3/h8-10H,4-7H2,1-3H3
InChIKeyHMKOSXMYMMZQQM-UHFFFAOYSA-N
XLogP2.85
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-1,3-dimethylcyclohexane?
The IUPAC name of 2-ethoxy-1,3-dimethylcyclohexane (CID 101096771) is 2-ethoxy-1,3-dimethylcyclohexane.
What is the SMILES notation for 2-ethoxy-1,3-dimethylcyclohexane?
The canonical SMILES for 2-ethoxy-1,3-dimethylcyclohexane is CCOC1C(C)CCCC1C.
What is the InChIKey of 2-ethoxy-1,3-dimethylcyclohexane?
The InChIKey is HMKOSXMYMMZQQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O/c1-4-11-10-8(2)6-5-7-9(10)3/h8-10H,4-7H2,1-3H3.
What are the key properties of 2-ethoxy-1,3-dimethylcyclohexane?
2-ethoxy-1,3-dimethylcyclohexane has a molecular weight of 156.27 g/mol, XLogP of 2.85, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-1,3-dimethylcyclohexane is sourced from PubChem (CID 101096771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).