(8R)-8-ethyl-4-propyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxine

C11H20O4 — CID 130254477

IUPAC(8R)-8-ethyl-4-propyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxine
SMILESCCCC1OCOC2C1OCO[C@@H]2CC
InChIInChI=1S/C11H20O4/c1-3-5-9-11-10(14-7-13-9)8(4-2)12-6-15-11/h8-11H,3-7H2,1-2H3/t8-,9?,10?,11?/m1/s1
InChIKeyVXRFDPJUWPVMEG-XUHYKBHQSA-N
MW216.28 g/mol
LogP1.68
Rot. Bonds3

About (8R)-8-ethyl-4-propyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxine

(8R)-8-ethyl-4-propyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxine (PubChem CID 130254477) has the molecular formula C11H20O4 and a molecular weight of 216.28 g/mol. Its IUPAC name is (8R)-8-ethyl-4-propyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxine.

Molecular Properties

Compound Name(8R)-8-ethyl-4-propyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxine
PubChem CID130254477
Molecular FormulaC11H20O4
Molecular Weight216.28 g/mol
Exact Mass216.14
IUPAC Name(8R)-8-ethyl-4-propyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxine
SMILESCCCC1OCOC2C1OCO[C@@H]2CC
InChIInChI=1S/C11H20O4/c1-3-5-9-11-10(14-7-13-9)8(4-2)12-6-15-11/h8-11H,3-7H2,1-2H3/t8-,9?,10?,11?/m1/s1
InChIKeyVXRFDPJUWPVMEG-XUHYKBHQSA-N
XLogP1.68
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (8R)-8-ethyl-4-propyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxine with MolForge

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Related Compounds

(4R)-4,8-diethyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxine
CID 58960567
(4R,4aR,8R,8aR)-8-ethyl-4-prop-2-ynyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxine
CID 144837078
CID 172625443
CID 172625443
4,5-diethyl-1,3-dioxolane;2,3-diethyloxirane
CID 142047920
[(4R,8R,8aR)-4-(hydroxymethyl)-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxin-8-yl]methanol
CID 163521645
1-(5-ethyl-1,3-dioxolan-4-yl)-N-methylmethanamine
CID 129125937
(2R,3R)-2-(2-bromoethyl)-3-propyl-1,4-dioxane
CID 97304593
(3S,3aR,6R,6aR)-3,6-dipropyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan
CID 59336408
2-propyl-1,3,5-trioxane
CID 68769940
(6aR)-3,6-dipropyl-2,3,3a,5,6,6a-hexahydrofuro[3,2-b]furan
CID 137382626
(2S,3S)-2-methyl-3-propyloxirane
CID 22844896
3-fluoro-2-propyloxolane
CID 156747497

Frequently Asked Questions

What is the IUPAC name of (8R)-8-ethyl-4-propyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxine?
The IUPAC name of (8R)-8-ethyl-4-propyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxine (CID 130254477) is (8R)-8-ethyl-4-propyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxine.
What is the SMILES notation for (8R)-8-ethyl-4-propyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxine?
The canonical SMILES for (8R)-8-ethyl-4-propyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxine is CCCC1OCOC2C1OCO[C@@H]2CC.
What is the InChIKey of (8R)-8-ethyl-4-propyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxine?
The InChIKey is VXRFDPJUWPVMEG-XUHYKBHQSA-N. The full InChI is InChI=1S/C11H20O4/c1-3-5-9-11-10(14-7-13-9)8(4-2)12-6-15-11/h8-11H,3-7H2,1-2H3/t8-,9?,10?,11?/m1/s1.
What are the key properties of (8R)-8-ethyl-4-propyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxine?
(8R)-8-ethyl-4-propyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxine has a molecular weight of 216.28 g/mol, XLogP of 1.68, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (8R)-8-ethyl-4-propyl-4,4a,8,8a-tetrahydro-[1,3]dioxino[5,4-d][1,3]dioxine is sourced from PubChem (CID 130254477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).