4-ethylidene-5-methyl-1,3-dioxolane

C6H10O2 — CID 90734562

IUPAC4-ethylidene-5-methyl-1,3-dioxolane
SMILESCC=C1OCOC1C
InChIInChI=1S/C6H10O2/c1-3-6-5(2)7-4-8-6/h3,5H,4H2,1-2H3
InChIKeyVWAICWOWJUBTHF-UHFFFAOYSA-N
MW114.14 g/mol
LogP1.28
Rot. Bonds

About 4-ethylidene-5-methyl-1,3-dioxolane

4-ethylidene-5-methyl-1,3-dioxolane (PubChem CID 90734562) has the molecular formula C6H10O2 and a molecular weight of 114.14 g/mol. Its IUPAC name is 4-ethylidene-5-methyl-1,3-dioxolane.

Molecular Properties

Compound Name4-ethylidene-5-methyl-1,3-dioxolane
PubChem CID90734562
Molecular FormulaC6H10O2
Molecular Weight114.14 g/mol
Exact Mass114.07
IUPAC Name4-ethylidene-5-methyl-1,3-dioxolane
SMILESCC=C1OCOC1C
InChIInChI=1S/C6H10O2/c1-3-6-5(2)7-4-8-6/h3,5H,4H2,1-2H3
InChIKeyVWAICWOWJUBTHF-UHFFFAOYSA-N
XLogP1.28
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.14
LogP ≤ 51.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-ethylidene-5-methyl-1,3-dioxolane?
The IUPAC name of 4-ethylidene-5-methyl-1,3-dioxolane (CID 90734562) is 4-ethylidene-5-methyl-1,3-dioxolane.
What is the SMILES notation for 4-ethylidene-5-methyl-1,3-dioxolane?
The canonical SMILES for 4-ethylidene-5-methyl-1,3-dioxolane is CC=C1OCOC1C.
What is the InChIKey of 4-ethylidene-5-methyl-1,3-dioxolane?
The InChIKey is VWAICWOWJUBTHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10O2/c1-3-6-5(2)7-4-8-6/h3,5H,4H2,1-2H3.
What are the key properties of 4-ethylidene-5-methyl-1,3-dioxolane?
4-ethylidene-5-methyl-1,3-dioxolane has a molecular weight of 114.14 g/mol, XLogP of 1.28, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethylidene-5-methyl-1,3-dioxolane is sourced from PubChem (CID 90734562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).