2,3-dihydrofuran-4-yl-(4-methoxyoxan-4-yl)methanone

C11H16O4 — CID 130579340

IUPAC2,3-dihydrofuran-4-yl-(4-methoxyoxan-4-yl)methanone
SMILESCOC1(C(=O)C2=COCC2)CCOCC1
InChIInChI=1S/C11H16O4/c1-13-11(3-6-14-7-4-11)10(12)9-2-5-15-8-9/h8H,2-7H2,1H3
InChIKeyUCRXDRJKOXGGTN-UHFFFAOYSA-N
MW212.24 g/mol
LogP1.06
Rot. Bonds3

About 2,3-dihydrofuran-4-yl-(4-methoxyoxan-4-yl)methanone

2,3-dihydrofuran-4-yl-(4-methoxyoxan-4-yl)methanone (PubChem CID 130579340) has the molecular formula C11H16O4 and a molecular weight of 212.24 g/mol. Its IUPAC name is 2,3-dihydrofuran-4-yl-(4-methoxyoxan-4-yl)methanone.

Molecular Properties

Compound Name2,3-dihydrofuran-4-yl-(4-methoxyoxan-4-yl)methanone
PubChem CID130579340
Molecular FormulaC11H16O4
Molecular Weight212.24 g/mol
Exact Mass212.10
IUPAC Name2,3-dihydrofuran-4-yl-(4-methoxyoxan-4-yl)methanone
SMILESCOC1(C(=O)C2=COCC2)CCOCC1
InChIInChI=1S/C11H16O4/c1-13-11(3-6-14-7-4-11)10(12)9-2-5-15-8-9/h8H,2-7H2,1H3
InChIKeyUCRXDRJKOXGGTN-UHFFFAOYSA-N
XLogP1.06
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.24
LogP ≤ 51.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3,4-dihydro-2H-pyran-5-yl-(4-methoxyoxan-4-yl)methanone
CID 116748588
3,4-dihydro-2H-pyran-5-yl-(4-ethoxyoxan-4-yl)methanone
CID 116748863
2,3-Dihydrofuran-4-yl-(1-methoxycyclobutyl)methanone
CID 130579338

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydrofuran-4-yl-(4-methoxyoxan-4-yl)methanone?
The IUPAC name of 2,3-dihydrofuran-4-yl-(4-methoxyoxan-4-yl)methanone (CID 130579340) is 2,3-dihydrofuran-4-yl-(4-methoxyoxan-4-yl)methanone.
What is the SMILES notation for 2,3-dihydrofuran-4-yl-(4-methoxyoxan-4-yl)methanone?
The canonical SMILES for 2,3-dihydrofuran-4-yl-(4-methoxyoxan-4-yl)methanone is COC1(C(=O)C2=COCC2)CCOCC1.
What is the InChIKey of 2,3-dihydrofuran-4-yl-(4-methoxyoxan-4-yl)methanone?
The InChIKey is UCRXDRJKOXGGTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16O4/c1-13-11(3-6-14-7-4-11)10(12)9-2-5-15-8-9/h8H,2-7H2,1H3.
What are the key properties of 2,3-dihydrofuran-4-yl-(4-methoxyoxan-4-yl)methanone?
2,3-dihydrofuran-4-yl-(4-methoxyoxan-4-yl)methanone has a molecular weight of 212.24 g/mol, XLogP of 1.06, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydrofuran-4-yl-(4-methoxyoxan-4-yl)methanone is sourced from PubChem (CID 130579340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).