2-[(2-bromophenyl)methyl]furan

C11H9BrO — CID 14063446

IUPAC2-[(2-bromophenyl)methyl]furan
SMILESBrc1ccccc1Cc1ccco1
InChIInChI=1S/C11H9BrO/c12-11-6-2-1-4-9(11)8-10-5-3-7-13-10/h1-7H,8H2
InChIKeyUFKCOMMKKGSGQC-UHFFFAOYSA-N
MW237.10 g/mol
LogP3.63
Rot. Bonds2

About 2-[(2-bromophenyl)methyl]furan

2-[(2-bromophenyl)methyl]furan (PubChem CID 14063446) has the molecular formula C11H9BrO and a molecular weight of 237.10 g/mol. Its IUPAC name is 2-[(2-bromophenyl)methyl]furan.

Molecular Properties

Compound Name2-[(2-bromophenyl)methyl]furan
PubChem CID14063446
Molecular FormulaC11H9BrO
Molecular Weight237.10 g/mol
Exact Mass235.98
IUPAC Name2-[(2-bromophenyl)methyl]furan
SMILESBrc1ccccc1Cc1ccco1
InChIInChI=1S/C11H9BrO/c12-11-6-2-1-4-9(11)8-10-5-3-7-13-10/h1-7H,8H2
InChIKeyUFKCOMMKKGSGQC-UHFFFAOYSA-N
XLogP3.63
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.10
LogP ≤ 53.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2-[(2-bromophenyl)methyl]furan with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[(2-bromophenyl)methyl]furan?
The IUPAC name of 2-[(2-bromophenyl)methyl]furan (CID 14063446) is 2-[(2-bromophenyl)methyl]furan.
What is the SMILES notation for 2-[(2-bromophenyl)methyl]furan?
The canonical SMILES for 2-[(2-bromophenyl)methyl]furan is Brc1ccccc1Cc1ccco1.
What is the InChIKey of 2-[(2-bromophenyl)methyl]furan?
The InChIKey is UFKCOMMKKGSGQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9BrO/c12-11-6-2-1-4-9(11)8-10-5-3-7-13-10/h1-7H,8H2.
What are the key properties of 2-[(2-bromophenyl)methyl]furan?
2-[(2-bromophenyl)methyl]furan has a molecular weight of 237.10 g/mol, XLogP of 3.63, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-bromophenyl)methyl]furan is sourced from PubChem (CID 14063446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).