4-(4-chlorophenyl)-2-methylfuran

C11H9ClO — CID 10867181

IUPAC4-(4-chlorophenyl)-2-methylfuran
SMILESCc1cc(-c2ccc(Cl)cc2)co1
InChIInChI=1S/C11H9ClO/c1-8-6-10(7-13-8)9-2-4-11(12)5-3-9/h2-7H,1H3
InChIKeyZGJREUXDWHZKBJ-UHFFFAOYSA-N
MW192.64 g/mol
LogP3.91
Rot. Bonds1

About 4-(4-chlorophenyl)-2-methylfuran

4-(4-chlorophenyl)-2-methylfuran (PubChem CID 10867181) has the molecular formula C11H9ClO and a molecular weight of 192.64 g/mol. Its IUPAC name is 4-(4-chlorophenyl)-2-methylfuran.

Molecular Properties

Compound Name4-(4-chlorophenyl)-2-methylfuran
PubChem CID10867181
Molecular FormulaC11H9ClO
Molecular Weight192.64 g/mol
Exact Mass192.03
IUPAC Name4-(4-chlorophenyl)-2-methylfuran
SMILESCc1cc(-c2ccc(Cl)cc2)co1
InChIInChI=1S/C11H9ClO/c1-8-6-10(7-13-8)9-2-4-11(12)5-3-9/h2-7H,1H3
InChIKeyZGJREUXDWHZKBJ-UHFFFAOYSA-N
XLogP3.91
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.64
LogP ≤ 53.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-(4-chlorophenyl)-2-methylfuran?
The IUPAC name of 4-(4-chlorophenyl)-2-methylfuran (CID 10867181) is 4-(4-chlorophenyl)-2-methylfuran.
What is the SMILES notation for 4-(4-chlorophenyl)-2-methylfuran?
The canonical SMILES for 4-(4-chlorophenyl)-2-methylfuran is Cc1cc(-c2ccc(Cl)cc2)co1.
What is the InChIKey of 4-(4-chlorophenyl)-2-methylfuran?
The InChIKey is ZGJREUXDWHZKBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClO/c1-8-6-10(7-13-8)9-2-4-11(12)5-3-9/h2-7H,1H3.
What are the key properties of 4-(4-chlorophenyl)-2-methylfuran?
4-(4-chlorophenyl)-2-methylfuran has a molecular weight of 192.64 g/mol, XLogP of 3.91, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-chlorophenyl)-2-methylfuran is sourced from PubChem (CID 10867181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).