2-(2-methylcyclopropyl)oxyethanol

C6H12O2 — CID 130122746

IUPAC2-(2-methylcyclopropyl)oxyethanol
SMILESCC1CC1OCCO
InChIInChI=1S/C6H12O2/c1-5-4-6(5)8-3-2-7/h5-7H,2-4H2,1H3
InChIKeyGAUCVTNYVVPFFM-UHFFFAOYSA-N
MW116.16 g/mol
LogP0.40
Rot. Bonds3

About 2-(2-methylcyclopropyl)oxyethanol

2-(2-methylcyclopropyl)oxyethanol (PubChem CID 130122746) has the molecular formula C6H12O2 and a molecular weight of 116.16 g/mol. Its IUPAC name is 2-(2-methylcyclopropyl)oxyethanol.

Molecular Properties

Compound Name2-(2-methylcyclopropyl)oxyethanol
PubChem CID130122746
Molecular FormulaC6H12O2
Molecular Weight116.16 g/mol
Exact Mass116.08
IUPAC Name2-(2-methylcyclopropyl)oxyethanol
SMILESCC1CC1OCCO
InChIInChI=1S/C6H12O2/c1-5-4-6(5)8-3-2-7/h5-7H,2-4H2,1H3
InChIKeyGAUCVTNYVVPFFM-UHFFFAOYSA-N
XLogP0.40
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.16
LogP ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methylcyclopropyl)oxyethanol?
The IUPAC name of 2-(2-methylcyclopropyl)oxyethanol (CID 130122746) is 2-(2-methylcyclopropyl)oxyethanol.
What is the SMILES notation for 2-(2-methylcyclopropyl)oxyethanol?
The canonical SMILES for 2-(2-methylcyclopropyl)oxyethanol is CC1CC1OCCO.
What is the InChIKey of 2-(2-methylcyclopropyl)oxyethanol?
The InChIKey is GAUCVTNYVVPFFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12O2/c1-5-4-6(5)8-3-2-7/h5-7H,2-4H2,1H3.
What are the key properties of 2-(2-methylcyclopropyl)oxyethanol?
2-(2-methylcyclopropyl)oxyethanol has a molecular weight of 116.16 g/mol, XLogP of 0.40, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylcyclopropyl)oxyethanol is sourced from PubChem (CID 130122746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).