2-(4-bromophenyl)furan

C10H7BrO — CID 11276114

IUPAC2-(4-bromophenyl)furan
SMILESBrc1ccc(-c2ccco2)cc1
InChIInChI=1S/C10H7BrO/c11-9-5-3-8(4-6-9)10-2-1-7-12-10/h1-7H
InChIKeyFBIKSVALROQWIY-UHFFFAOYSA-N
MW223.07 g/mol
LogP3.71
Rot. Bonds1

About 2-(4-bromophenyl)furan

2-(4-bromophenyl)furan (PubChem CID 11276114) has the molecular formula C10H7BrO and a molecular weight of 223.07 g/mol. Its IUPAC name is 2-(4-bromophenyl)furan.

Molecular Properties

Compound Name2-(4-bromophenyl)furan
PubChem CID11276114
Molecular FormulaC10H7BrO
Molecular Weight223.07 g/mol
Exact Mass221.97
IUPAC Name2-(4-bromophenyl)furan
SMILESBrc1ccc(-c2ccco2)cc1
InChIInChI=1S/C10H7BrO/c11-9-5-3-8(4-6-9)10-2-1-7-12-10/h1-7H
InChIKeyFBIKSVALROQWIY-UHFFFAOYSA-N
XLogP3.71
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.07
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(4-bromophenyl)furan?
The IUPAC name of 2-(4-bromophenyl)furan (CID 11276114) is 2-(4-bromophenyl)furan.
What is the SMILES notation for 2-(4-bromophenyl)furan?
The canonical SMILES for 2-(4-bromophenyl)furan is Brc1ccc(-c2ccco2)cc1.
What is the InChIKey of 2-(4-bromophenyl)furan?
The InChIKey is FBIKSVALROQWIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7BrO/c11-9-5-3-8(4-6-9)10-2-1-7-12-10/h1-7H.
What are the key properties of 2-(4-bromophenyl)furan?
2-(4-bromophenyl)furan has a molecular weight of 223.07 g/mol, XLogP of 3.71, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromophenyl)furan is sourced from PubChem (CID 11276114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).