(2-chlorofuran-3-yl)-(4-fluorophenyl)methanone

C11H6ClFO2 — CID 106683687

IUPAC(2-chlorofuran-3-yl)-(4-fluorophenyl)methanone
SMILESO=C(c1ccc(F)cc1)c1ccoc1Cl
InChIInChI=1S/C11H6ClFO2/c12-11-9(5-6-15-11)10(14)7-1-3-8(13)4-2-7/h1-6H
InChIKeyNWNNGFCEKPTMPA-UHFFFAOYSA-N
MW224.62 g/mol
LogP3.30
Rot. Bonds2

About (2-chlorofuran-3-yl)-(4-fluorophenyl)methanone

(2-chlorofuran-3-yl)-(4-fluorophenyl)methanone (PubChem CID 106683687) has the molecular formula C11H6ClFO2 and a molecular weight of 224.62 g/mol. Its IUPAC name is (2-chlorofuran-3-yl)-(4-fluorophenyl)methanone.

Molecular Properties

Compound Name(2-chlorofuran-3-yl)-(4-fluorophenyl)methanone
PubChem CID106683687
Molecular FormulaC11H6ClFO2
Molecular Weight224.62 g/mol
Exact Mass224.00
IUPAC Name(2-chlorofuran-3-yl)-(4-fluorophenyl)methanone
SMILESO=C(c1ccc(F)cc1)c1ccoc1Cl
InChIInChI=1S/C11H6ClFO2/c12-11-9(5-6-15-11)10(14)7-1-3-8(13)4-2-7/h1-6H
InChIKeyNWNNGFCEKPTMPA-UHFFFAOYSA-N
XLogP3.30
TPSA30.21 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.62
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2-chlorofuran-3-yl)-(4-fluorophenyl)methanone?
The IUPAC name of (2-chlorofuran-3-yl)-(4-fluorophenyl)methanone (CID 106683687) is (2-chlorofuran-3-yl)-(4-fluorophenyl)methanone.
What is the SMILES notation for (2-chlorofuran-3-yl)-(4-fluorophenyl)methanone?
The canonical SMILES for (2-chlorofuran-3-yl)-(4-fluorophenyl)methanone is O=C(c1ccc(F)cc1)c1ccoc1Cl.
What is the InChIKey of (2-chlorofuran-3-yl)-(4-fluorophenyl)methanone?
The InChIKey is NWNNGFCEKPTMPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6ClFO2/c12-11-9(5-6-15-11)10(14)7-1-3-8(13)4-2-7/h1-6H.
What are the key properties of (2-chlorofuran-3-yl)-(4-fluorophenyl)methanone?
(2-chlorofuran-3-yl)-(4-fluorophenyl)methanone has a molecular weight of 224.62 g/mol, XLogP of 3.30, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chlorofuran-3-yl)-(4-fluorophenyl)methanone is sourced from PubChem (CID 106683687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).