(5-chlorofuran-2-yl)-(5-ethylfuran-2-yl)methanone

C11H9ClO3 — CID 106683821

IUPAC(5-chlorofuran-2-yl)-(5-ethylfuran-2-yl)methanone
SMILESCCc1ccc(C(=O)c2ccc(Cl)o2)o1
InChIInChI=1S/C11H9ClO3/c1-2-7-3-4-8(14-7)11(13)9-5-6-10(12)15-9/h3-6H,2H2,1H3
InChIKeyUKUXLMLARDDGBS-UHFFFAOYSA-N
MW224.64 g/mol
LogP3.32
Rot. Bonds3

About (5-chlorofuran-2-yl)-(5-ethylfuran-2-yl)methanone

(5-chlorofuran-2-yl)-(5-ethylfuran-2-yl)methanone (PubChem CID 106683821) has the molecular formula C11H9ClO3 and a molecular weight of 224.64 g/mol. Its IUPAC name is (5-chlorofuran-2-yl)-(5-ethylfuran-2-yl)methanone.

Molecular Properties

Compound Name(5-chlorofuran-2-yl)-(5-ethylfuran-2-yl)methanone
PubChem CID106683821
Molecular FormulaC11H9ClO3
Molecular Weight224.64 g/mol
Exact Mass224.02
IUPAC Name(5-chlorofuran-2-yl)-(5-ethylfuran-2-yl)methanone
SMILESCCc1ccc(C(=O)c2ccc(Cl)o2)o1
InChIInChI=1S/C11H9ClO3/c1-2-7-3-4-8(14-7)11(13)9-5-6-10(12)15-9/h3-6H,2H2,1H3
InChIKeyUKUXLMLARDDGBS-UHFFFAOYSA-N
XLogP3.32
TPSA43.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.64
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(3-chloro-4-methylphenyl)-(5-ethylfuran-2-yl)methanone
CID 63194528
5-(5-chlorofuran-2-carbonyl)furan-2-carboxylic acid
CID 106946887
(5-chloro-4-methylthiophen-2-yl)-(5-ethylfuran-2-yl)methanone
CID 102762955
(3-bromofuran-2-yl)-(5-ethylfuran-2-yl)methanone
CID 114973336
1-(5-ethylfuran-2-yl)butan-1-one
CID 62344781
5-ethyl-N-methylfuran-2-carboxamide
CID 60751451
[4-bromo-2-(trifluoromethyl)phenyl]-(5-ethylfuran-2-yl)methanone
CID 107332667
acetylene;2-chloro-5-ethylfuran;2-methylpropane
CID 143076858
(4-bromo-5-methylthiophen-2-yl)-(5-ethylfuran-2-yl)methanone
CID 102826505
1-(5-ethylfuran-2-yl)prop-2-yn-1-one
CID 114978456
(5-ethylfuran-2-yl)-(2-methylpyrazol-3-yl)methanone
CID 114972553
cyclohexen-1-yl-(5-ethylfuran-2-yl)methanone
CID 79096660

Frequently Asked Questions

What is the IUPAC name of (5-chlorofuran-2-yl)-(5-ethylfuran-2-yl)methanone?
The IUPAC name of (5-chlorofuran-2-yl)-(5-ethylfuran-2-yl)methanone (CID 106683821) is (5-chlorofuran-2-yl)-(5-ethylfuran-2-yl)methanone.
What is the SMILES notation for (5-chlorofuran-2-yl)-(5-ethylfuran-2-yl)methanone?
The canonical SMILES for (5-chlorofuran-2-yl)-(5-ethylfuran-2-yl)methanone is CCc1ccc(C(=O)c2ccc(Cl)o2)o1.
What is the InChIKey of (5-chlorofuran-2-yl)-(5-ethylfuran-2-yl)methanone?
The InChIKey is UKUXLMLARDDGBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClO3/c1-2-7-3-4-8(14-7)11(13)9-5-6-10(12)15-9/h3-6H,2H2,1H3.
What are the key properties of (5-chlorofuran-2-yl)-(5-ethylfuran-2-yl)methanone?
(5-chlorofuran-2-yl)-(5-ethylfuran-2-yl)methanone has a molecular weight of 224.64 g/mol, XLogP of 3.32, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chlorofuran-2-yl)-(5-ethylfuran-2-yl)methanone is sourced from PubChem (CID 106683821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).