2-(5-methyl-2-propan-2-ylcyclohexyl)oxyethanol

C12H24O2 — CID 14064911

IUPAC2-(5-methyl-2-propan-2-ylcyclohexyl)oxyethanol
SMILESCC1CCC(C(C)C)C(OCCO)C1
InChIInChI=1S/C12H24O2/c1-9(2)11-5-4-10(3)8-12(11)14-7-6-13/h9-13H,4-8H2,1-3H3
InChIKeyFVBGFZNFXUIHNC-UHFFFAOYSA-N
MW200.32 g/mol
LogP2.46
Rot. Bonds4

About 2-(5-methyl-2-propan-2-ylcyclohexyl)oxyethanol

2-(5-methyl-2-propan-2-ylcyclohexyl)oxyethanol (PubChem CID 14064911) has the molecular formula C12H24O2 and a molecular weight of 200.32 g/mol. Its IUPAC name is 2-(5-methyl-2-propan-2-ylcyclohexyl)oxyethanol.

Molecular Properties

Compound Name2-(5-methyl-2-propan-2-ylcyclohexyl)oxyethanol
PubChem CID14064911
Molecular FormulaC12H24O2
Molecular Weight200.32 g/mol
Exact Mass200.18
IUPAC Name2-(5-methyl-2-propan-2-ylcyclohexyl)oxyethanol
SMILESCC1CCC(C(C)C)C(OCCO)C1
InChIInChI=1S/C12H24O2/c1-9(2)11-5-4-10(3)8-12(11)14-7-6-13/h9-13H,4-8H2,1-3H3
InChIKeyFVBGFZNFXUIHNC-UHFFFAOYSA-N
XLogP2.46
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.32
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-2-propan-2-ylcyclohexyl)oxyethanol?
The IUPAC name of 2-(5-methyl-2-propan-2-ylcyclohexyl)oxyethanol (CID 14064911) is 2-(5-methyl-2-propan-2-ylcyclohexyl)oxyethanol.
What is the SMILES notation for 2-(5-methyl-2-propan-2-ylcyclohexyl)oxyethanol?
The canonical SMILES for 2-(5-methyl-2-propan-2-ylcyclohexyl)oxyethanol is CC1CCC(C(C)C)C(OCCO)C1.
What is the InChIKey of 2-(5-methyl-2-propan-2-ylcyclohexyl)oxyethanol?
The InChIKey is FVBGFZNFXUIHNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24O2/c1-9(2)11-5-4-10(3)8-12(11)14-7-6-13/h9-13H,4-8H2,1-3H3.
What are the key properties of 2-(5-methyl-2-propan-2-ylcyclohexyl)oxyethanol?
2-(5-methyl-2-propan-2-ylcyclohexyl)oxyethanol has a molecular weight of 200.32 g/mol, XLogP of 2.46, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-2-propan-2-ylcyclohexyl)oxyethanol is sourced from PubChem (CID 14064911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).