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

C11H18O4 — CID 158529297

IUPAC5,6-dimethyl-2,3-dihydro-1,4-dioxine;4,5-dimethyl-1,3-dioxole
SMILESCC1=C(C)OCCO1.CC1=C(C)OCO1
InChIInChI=1S/C6H10O2.C5H8O2/c1-5-6(2)8-4-3-7-5;1-4-5(2)7-3-6-4/h3-4H2,1-2H3;3H2,1-2H3
InChIKeyHNEBHHAUSIOKLR-UHFFFAOYSA-N
MW214.26 g/mol
LogP2.53
Rot. Bonds

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

5,6-dimethyl-2,3-dihydro-1,4-dioxine;4,5-dimethyl-1,3-dioxole (PubChem CID 158529297) has the molecular formula C11H18O4 and a molecular weight of 214.26 g/mol. Its IUPAC name is 5,6-dimethyl-2,3-dihydro-1,4-dioxine;4,5-dimethyl-1,3-dioxole.

Molecular Properties

Compound Name5,6-dimethyl-2,3-dihydro-1,4-dioxine;4,5-dimethyl-1,3-dioxole
PubChem CID158529297
Molecular FormulaC11H18O4
Molecular Weight214.26 g/mol
Exact Mass214.12
IUPAC Name5,6-dimethyl-2,3-dihydro-1,4-dioxine;4,5-dimethyl-1,3-dioxole
SMILESCC1=C(C)OCCO1.CC1=C(C)OCO1
InChIInChI=1S/C6H10O2.C5H8O2/c1-5-6(2)8-4-3-7-5;1-4-5(2)7-3-6-4/h3-4H2,1-2H3;3H2,1-2H3
InChIKeyHNEBHHAUSIOKLR-UHFFFAOYSA-N
XLogP2.53
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 5,6-dimethyl-2,3-dihydro-1,4-dioxine;4,5-dimethyl-1,3-dioxole with MolForge

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Launch Full Analysis

Related Compounds

4,5-dimethyl-1,3-dioxole
CID 13058524
4-iodo-5-methyl-2,3-dihydrofuran
CID 53376968
7,7,8,8-tetramethyl-2,5-dioxabicyclo[4.2.0]oct-1(6)-ene
CID 170927555
4,7-dimethyl-5,6-dihydro-1,3-benzodioxole
CID 143987366
5,6-dimethyl-2,3-dihydro-1,4-oxaselenine
CID 164804759
4-methyl-5-[(Z)-3-methylbut-1-enyl]-1,3-dioxole
CID 143193856
5,6-dimethyl-4-methylidene-2,3-dihydro-1,4-oxathiine
CID 20658718
6,7-dimethyl-2,3,4,5-tetrahydro-1,4-oxazepine
CID 90942786
5-bromo-6-methyl-2,3-dihydropyran-4-one
CID 10774061
(5-methyl-1,3-dioxol-4-yl)methyl acetate
CID 163804713
6-methyl-5-(trifluoromethyl)-2,3-dihydro-1,4-oxathiine
CID 22980776
1,3-dioxetan-2-one
CID 10964397

Frequently Asked Questions

What is the IUPAC name of 5,6-dimethyl-2,3-dihydro-1,4-dioxine;4,5-dimethyl-1,3-dioxole?
The IUPAC name of 5,6-dimethyl-2,3-dihydro-1,4-dioxine;4,5-dimethyl-1,3-dioxole (CID 158529297) is 5,6-dimethyl-2,3-dihydro-1,4-dioxine;4,5-dimethyl-1,3-dioxole.
What is the SMILES notation for 5,6-dimethyl-2,3-dihydro-1,4-dioxine;4,5-dimethyl-1,3-dioxole?
The canonical SMILES for 5,6-dimethyl-2,3-dihydro-1,4-dioxine;4,5-dimethyl-1,3-dioxole is CC1=C(C)OCCO1.CC1=C(C)OCO1.
What is the InChIKey of 5,6-dimethyl-2,3-dihydro-1,4-dioxine;4,5-dimethyl-1,3-dioxole?
The InChIKey is HNEBHHAUSIOKLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10O2.C5H8O2/c1-5-6(2)8-4-3-7-5;1-4-5(2)7-3-6-4/h3-4H2,1-2H3;3H2,1-2H3.
What are the key properties of 5,6-dimethyl-2,3-dihydro-1,4-dioxine;4,5-dimethyl-1,3-dioxole?
5,6-dimethyl-2,3-dihydro-1,4-dioxine;4,5-dimethyl-1,3-dioxole has a molecular weight of 214.26 g/mol, XLogP of 2.53, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dimethyl-2,3-dihydro-1,4-dioxine;4,5-dimethyl-1,3-dioxole is sourced from PubChem (CID 158529297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).