dibenzofuran-2-yl(1,4-dioxan-2-yl)methanone

C17H14O4 — CID 62799394

IUPACdibenzofuran-2-yl(1,4-dioxan-2-yl)methanone
SMILESO=C(c1ccc2oc3ccccc3c2c1)C1COCCO1
InChIInChI=1S/C17H14O4/c18-17(16-10-19-7-8-20-16)11-5-6-15-13(9-11)12-3-1-2-4-14(12)21-15/h1-6,9,16H,7-8,10H2
InChIKeyJWOSWLVZLSXNTP-UHFFFAOYSA-N
MW282.29 g/mol
LogP3.18
Rot. Bonds2

About dibenzofuran-2-yl(1,4-dioxan-2-yl)methanone

dibenzofuran-2-yl(1,4-dioxan-2-yl)methanone (PubChem CID 62799394) has the molecular formula C17H14O4 and a molecular weight of 282.29 g/mol. Its IUPAC name is dibenzofuran-2-yl(1,4-dioxan-2-yl)methanone.

Molecular Properties

Compound Namedibenzofuran-2-yl(1,4-dioxan-2-yl)methanone
PubChem CID62799394
Molecular FormulaC17H14O4
Molecular Weight282.29 g/mol
Exact Mass282.09
IUPAC Namedibenzofuran-2-yl(1,4-dioxan-2-yl)methanone
SMILESO=C(c1ccc2oc3ccccc3c2c1)C1COCCO1
InChIInChI=1S/C17H14O4/c18-17(16-10-19-7-8-20-16)11-5-6-15-13(9-11)12-3-1-2-4-14(12)21-15/h1-6,9,16H,7-8,10H2
InChIKeyJWOSWLVZLSXNTP-UHFFFAOYSA-N
XLogP3.18
TPSA48.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.29
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of dibenzofuran-2-yl(1,4-dioxan-2-yl)methanone?
The IUPAC name of dibenzofuran-2-yl(1,4-dioxan-2-yl)methanone (CID 62799394) is dibenzofuran-2-yl(1,4-dioxan-2-yl)methanone.
What is the SMILES notation for dibenzofuran-2-yl(1,4-dioxan-2-yl)methanone?
The canonical SMILES for dibenzofuran-2-yl(1,4-dioxan-2-yl)methanone is O=C(c1ccc2oc3ccccc3c2c1)C1COCCO1.
What is the InChIKey of dibenzofuran-2-yl(1,4-dioxan-2-yl)methanone?
The InChIKey is JWOSWLVZLSXNTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14O4/c18-17(16-10-19-7-8-20-16)11-5-6-15-13(9-11)12-3-1-2-4-14(12)21-15/h1-6,9,16H,7-8,10H2.
What are the key properties of dibenzofuran-2-yl(1,4-dioxan-2-yl)methanone?
dibenzofuran-2-yl(1,4-dioxan-2-yl)methanone has a molecular weight of 282.29 g/mol, XLogP of 3.18, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for dibenzofuran-2-yl(1,4-dioxan-2-yl)methanone is sourced from PubChem (CID 62799394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).