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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Related Compounds

[4-(dibenzofuran-2-carbonyl)phenyl]-dibenzofuran-2-ylmethanone
CID 71375763
dibenzofuran-2-yl-(9-methyl-3-oxa-9-azabicyclo[3.3.1]nonan-7-yl)methanone
CID 171939269
2,3-dihydro-1-benzofuran-5-yl(1,4-dioxan-2-yl)methanone
CID 62799399
methyl dibenzofuran-2-carboxylate
CID 3702628
1-(10,14-dioxapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1,3(11),4(9),5,7,12,15,17,19-nonaen-6-yl)ethanone
CID 170226916
1-dibenzofuran-2-yl-2-phenylethanone
CID 15691957
(2R)-N-dibenzofuran-3-yloxolane-2-carboxamide
CID 7269123
1-dibenzofuran-2-yl-3-methylbutan-1-one
CID 43160223
2-prop-1-en-2-yldibenzofuran
CID 142504770
(4-butan-2-ylphenyl)-(1,4-dioxan-2-yl)methanone
CID 62799391
N-naphthalen-1-yldibenzofuran-2-carboxamide
CID 18876147
N-propyldibenzofuran-2-carboxamide
CID 19048225

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).