5,6-dimethyl-2,3-dihydro-1,4-dioxine;ethane

C8H16O2 — CID 91323625

IUPAC5,6-dimethyl-2,3-dihydro-1,4-dioxine;ethane
SMILESCC.CC1=C(C)OCCO1
InChIInChI=1S/C6H10O2.C2H6/c1-5-6(2)8-4-3-7-5;1-2/h3-4H2,1-2H3;1-2H3
InChIKeyGLWQIKJMCKGOEZ-UHFFFAOYSA-N
MW144.21 g/mol
LogP2.31
Rot. Bonds

About 5,6-dimethyl-2,3-dihydro-1,4-dioxine;ethane

5,6-dimethyl-2,3-dihydro-1,4-dioxine;ethane (PubChem CID 91323625) has the molecular formula C8H16O2 and a molecular weight of 144.21 g/mol. Its IUPAC name is 5,6-dimethyl-2,3-dihydro-1,4-dioxine;ethane.

Molecular Properties

Compound Name5,6-dimethyl-2,3-dihydro-1,4-dioxine;ethane
PubChem CID91323625
Molecular FormulaC8H16O2
Molecular Weight144.21 g/mol
Exact Mass144.12
IUPAC Name5,6-dimethyl-2,3-dihydro-1,4-dioxine;ethane
SMILESCC.CC1=C(C)OCCO1
InChIInChI=1S/C6H10O2.C2H6/c1-5-6(2)8-4-3-7-5;1-2/h3-4H2,1-2H3;1-2H3
InChIKeyGLWQIKJMCKGOEZ-UHFFFAOYSA-N
XLogP2.31
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.21
LogP ≤ 52.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5,6-dimethyl-2,3-dihydro-1,4-dioxine;ethane?
The IUPAC name of 5,6-dimethyl-2,3-dihydro-1,4-dioxine;ethane (CID 91323625) is 5,6-dimethyl-2,3-dihydro-1,4-dioxine;ethane.
What is the SMILES notation for 5,6-dimethyl-2,3-dihydro-1,4-dioxine;ethane?
The canonical SMILES for 5,6-dimethyl-2,3-dihydro-1,4-dioxine;ethane is CC.CC1=C(C)OCCO1.
What is the InChIKey of 5,6-dimethyl-2,3-dihydro-1,4-dioxine;ethane?
The InChIKey is GLWQIKJMCKGOEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10O2.C2H6/c1-5-6(2)8-4-3-7-5;1-2/h3-4H2,1-2H3;1-2H3.
What are the key properties of 5,6-dimethyl-2,3-dihydro-1,4-dioxine;ethane?
5,6-dimethyl-2,3-dihydro-1,4-dioxine;ethane has a molecular weight of 144.21 g/mol, XLogP of 2.31, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dimethyl-2,3-dihydro-1,4-dioxine;ethane is sourced from PubChem (CID 91323625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).