2-(5,6-dimethylideneoxan-2-yl)ethanol

C9H14O2 — CID 123437750

IUPAC2-(5,6-dimethylideneoxan-2-yl)ethanol
SMILESC=C1CCC(CCO)OC1=C
InChIInChI=1S/C9H14O2/c1-7-3-4-9(5-6-10)11-8(7)2/h9-10H,1-6H2
InChIKeyBACROULLNHJKSJ-UHFFFAOYSA-N
MW154.21 g/mol
LogP1.62
Rot. Bonds2

About 2-(5,6-dimethylideneoxan-2-yl)ethanol

2-(5,6-dimethylideneoxan-2-yl)ethanol (PubChem CID 123437750) has the molecular formula C9H14O2 and a molecular weight of 154.21 g/mol. Its IUPAC name is 2-(5,6-dimethylideneoxan-2-yl)ethanol.

Molecular Properties

Compound Name2-(5,6-dimethylideneoxan-2-yl)ethanol
PubChem CID123437750
Molecular FormulaC9H14O2
Molecular Weight154.21 g/mol
Exact Mass154.10
IUPAC Name2-(5,6-dimethylideneoxan-2-yl)ethanol
SMILESC=C1CCC(CCO)OC1=C
InChIInChI=1S/C9H14O2/c1-7-3-4-9(5-6-10)11-8(7)2/h9-10H,1-6H2
InChIKeyBACROULLNHJKSJ-UHFFFAOYSA-N
XLogP1.62
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(5,6-dimethylideneoxan-2-yl)ethanol?
The IUPAC name of 2-(5,6-dimethylideneoxan-2-yl)ethanol (CID 123437750) is 2-(5,6-dimethylideneoxan-2-yl)ethanol.
What is the SMILES notation for 2-(5,6-dimethylideneoxan-2-yl)ethanol?
The canonical SMILES for 2-(5,6-dimethylideneoxan-2-yl)ethanol is C=C1CCC(CCO)OC1=C.
What is the InChIKey of 2-(5,6-dimethylideneoxan-2-yl)ethanol?
The InChIKey is BACROULLNHJKSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14O2/c1-7-3-4-9(5-6-10)11-8(7)2/h9-10H,1-6H2.
What are the key properties of 2-(5,6-dimethylideneoxan-2-yl)ethanol?
2-(5,6-dimethylideneoxan-2-yl)ethanol has a molecular weight of 154.21 g/mol, XLogP of 1.62, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5,6-dimethylideneoxan-2-yl)ethanol is sourced from PubChem (CID 123437750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).