bis(2-methoxyoxolan-2-yl)methanone

C11H18O5 — CID 67688639

IUPACbis(2-methoxyoxolan-2-yl)methanone
SMILESCOC1(C(=O)C2(OC)CCCO2)CCCO1
InChIInChI=1S/C11H18O5/c1-13-10(5-3-7-15-10)9(12)11(14-2)6-4-8-16-11/h3-8H2,1-2H3
InChIKeyHIPJXYUPKNUEKD-UHFFFAOYSA-N
MW230.26 g/mol
LogP0.86
Rot. Bonds4

About bis(2-methoxyoxolan-2-yl)methanone

bis(2-methoxyoxolan-2-yl)methanone (PubChem CID 67688639) has the molecular formula C11H18O5 and a molecular weight of 230.26 g/mol. Its IUPAC name is bis(2-methoxyoxolan-2-yl)methanone.

Molecular Properties

Compound Namebis(2-methoxyoxolan-2-yl)methanone
PubChem CID67688639
Molecular FormulaC11H18O5
Molecular Weight230.26 g/mol
Exact Mass230.12
IUPAC Namebis(2-methoxyoxolan-2-yl)methanone
SMILESCOC1(C(=O)C2(OC)CCCO2)CCCO1
InChIInChI=1S/C11H18O5/c1-13-10(5-3-7-15-10)9(12)11(14-2)6-4-8-16-11/h3-8H2,1-2H3
InChIKeyHIPJXYUPKNUEKD-UHFFFAOYSA-N
XLogP0.86
TPSA53.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.26
LogP ≤ 50.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of bis(2-methoxyoxolan-2-yl)methanone?
The IUPAC name of bis(2-methoxyoxolan-2-yl)methanone (CID 67688639) is bis(2-methoxyoxolan-2-yl)methanone.
What is the SMILES notation for bis(2-methoxyoxolan-2-yl)methanone?
The canonical SMILES for bis(2-methoxyoxolan-2-yl)methanone is COC1(C(=O)C2(OC)CCCO2)CCCO1.
What is the InChIKey of bis(2-methoxyoxolan-2-yl)methanone?
The InChIKey is HIPJXYUPKNUEKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18O5/c1-13-10(5-3-7-15-10)9(12)11(14-2)6-4-8-16-11/h3-8H2,1-2H3.
What are the key properties of bis(2-methoxyoxolan-2-yl)methanone?
bis(2-methoxyoxolan-2-yl)methanone has a molecular weight of 230.26 g/mol, XLogP of 0.86, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-methoxyoxolan-2-yl)methanone is sourced from PubChem (CID 67688639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).