2-(2-ethyl-2-methylcyclopropyl)ethanol

C8H16O — CID 72514759

IUPAC2-(2-ethyl-2-methylcyclopropyl)ethanol
SMILESCCC1(C)CC1CCO
InChIInChI=1S/C8H16O/c1-3-8(2)6-7(8)4-5-9/h7,9H,3-6H2,1-2H3
InChIKeyCRHZHMLXEOWQMU-UHFFFAOYSA-N
MW128.22 g/mol
LogP1.80
Rot. Bonds3

About 2-(2-ethyl-2-methylcyclopropyl)ethanol

2-(2-ethyl-2-methylcyclopropyl)ethanol (PubChem CID 72514759) has the molecular formula C8H16O and a molecular weight of 128.22 g/mol. Its IUPAC name is 2-(2-ethyl-2-methylcyclopropyl)ethanol.

Molecular Properties

Compound Name2-(2-ethyl-2-methylcyclopropyl)ethanol
PubChem CID72514759
Molecular FormulaC8H16O
Molecular Weight128.22 g/mol
Exact Mass128.12
IUPAC Name2-(2-ethyl-2-methylcyclopropyl)ethanol
SMILESCCC1(C)CC1CCO
InChIInChI=1S/C8H16O/c1-3-8(2)6-7(8)4-5-9/h7,9H,3-6H2,1-2H3
InChIKeyCRHZHMLXEOWQMU-UHFFFAOYSA-N
XLogP1.80
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.22
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(2-ethyl-2-methylcyclopropyl)ethanol?
The IUPAC name of 2-(2-ethyl-2-methylcyclopropyl)ethanol (CID 72514759) is 2-(2-ethyl-2-methylcyclopropyl)ethanol.
What is the SMILES notation for 2-(2-ethyl-2-methylcyclopropyl)ethanol?
The canonical SMILES for 2-(2-ethyl-2-methylcyclopropyl)ethanol is CCC1(C)CC1CCO.
What is the InChIKey of 2-(2-ethyl-2-methylcyclopropyl)ethanol?
The InChIKey is CRHZHMLXEOWQMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O/c1-3-8(2)6-7(8)4-5-9/h7,9H,3-6H2,1-2H3.
What are the key properties of 2-(2-ethyl-2-methylcyclopropyl)ethanol?
2-(2-ethyl-2-methylcyclopropyl)ethanol has a molecular weight of 128.22 g/mol, XLogP of 1.80, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethyl-2-methylcyclopropyl)ethanol is sourced from PubChem (CID 72514759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).