[5-(3-chlorophenyl)furan-2-yl]methanol

C11H9ClO2 — CID 720975

IUPAC[5-(3-chlorophenyl)furan-2-yl]methanol
SMILESOCc1ccc(-c2cccc(Cl)c2)o1
InChIInChI=1S/C11H9ClO2/c12-9-3-1-2-8(6-9)11-5-4-10(7-13)14-11/h1-6,13H,7H2
InChIKeyPFIJYKYXECJDLO-UHFFFAOYSA-N
MW208.64 g/mol
LogP3.09
Rot. Bonds2

About [5-(3-chlorophenyl)furan-2-yl]methanol

[5-(3-chlorophenyl)furan-2-yl]methanol (PubChem CID 720975) has the molecular formula C11H9ClO2 and a molecular weight of 208.64 g/mol. Its IUPAC name is [5-(3-chlorophenyl)furan-2-yl]methanol.

Molecular Properties

Compound Name[5-(3-chlorophenyl)furan-2-yl]methanol
PubChem CID720975
Molecular FormulaC11H9ClO2
Molecular Weight208.64 g/mol
Exact Mass208.03
IUPAC Name[5-(3-chlorophenyl)furan-2-yl]methanol
SMILESOCc1ccc(-c2cccc(Cl)c2)o1
InChIInChI=1S/C11H9ClO2/c12-9-3-1-2-8(6-9)11-5-4-10(7-13)14-11/h1-6,13H,7H2
InChIKeyPFIJYKYXECJDLO-UHFFFAOYSA-N
XLogP3.09
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.64
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [5-(3-chlorophenyl)furan-2-yl]methanol?
The IUPAC name of [5-(3-chlorophenyl)furan-2-yl]methanol (CID 720975) is [5-(3-chlorophenyl)furan-2-yl]methanol.
What is the SMILES notation for [5-(3-chlorophenyl)furan-2-yl]methanol?
The canonical SMILES for [5-(3-chlorophenyl)furan-2-yl]methanol is OCc1ccc(-c2cccc(Cl)c2)o1.
What is the InChIKey of [5-(3-chlorophenyl)furan-2-yl]methanol?
The InChIKey is PFIJYKYXECJDLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClO2/c12-9-3-1-2-8(6-9)11-5-4-10(7-13)14-11/h1-6,13H,7H2.
What are the key properties of [5-(3-chlorophenyl)furan-2-yl]methanol?
[5-(3-chlorophenyl)furan-2-yl]methanol has a molecular weight of 208.64 g/mol, XLogP of 3.09, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(3-chlorophenyl)furan-2-yl]methanol is sourced from PubChem (CID 720975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).