2-(2-bromo-6-methylphenyl)furan

C11H9BrO — CID 168524558

IUPAC2-(2-bromo-6-methylphenyl)furan
SMILESCc1cccc(Br)c1-c1ccco1
InChIInChI=1S/C11H9BrO/c1-8-4-2-5-9(12)11(8)10-6-3-7-13-10/h2-7H,1H3
InChIKeyPUWOYESXEUOFNA-UHFFFAOYSA-N
MW237.10 g/mol
LogP4.02
Rot. Bonds1

About 2-(2-bromo-6-methylphenyl)furan

2-(2-bromo-6-methylphenyl)furan (PubChem CID 168524558) has the molecular formula C11H9BrO and a molecular weight of 237.10 g/mol. Its IUPAC name is 2-(2-bromo-6-methylphenyl)furan.

Molecular Properties

Compound Name2-(2-bromo-6-methylphenyl)furan
PubChem CID168524558
Molecular FormulaC11H9BrO
Molecular Weight237.10 g/mol
Exact Mass235.98
IUPAC Name2-(2-bromo-6-methylphenyl)furan
SMILESCc1cccc(Br)c1-c1ccco1
InChIInChI=1S/C11H9BrO/c1-8-4-2-5-9(12)11(8)10-6-3-7-13-10/h2-7H,1H3
InChIKeyPUWOYESXEUOFNA-UHFFFAOYSA-N
XLogP4.02
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.10
LogP ≤ 54.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(3-bromo-2,6-dimethylphenyl)furan
CID 168526131
1-bromo-2-(2-bromo-6-methylphenyl)-3-methylbenzene
CID 14113190
2-(2,6-dibromo-3,4-dimethylphenyl)furan
CID 168524606
4-bromo-1-(furan-2-yl)-2-methylanthracene-9,10-dione
CID 168525701
ethane;2-(furan-2-yl)furan
CID 161366084
ethane;2-(2-methylphenyl)furan
CID 142082580
2-(2-chloro-3-methylphenyl)furan
CID 168528578
2-(4-bromo-5-chloro-2-methylphenyl)furan
CID 168524424
2-(furan-2-yl)-5-methylbenzene-1,4-diamine
CID 18798879
2-(2,4-dibromo-3-methylphenyl)furan
CID 168526027
5-(2-bromo-6-methylphenyl)-2-(chloromethyl)-1,3-oxazole
CID 130624755
2-(2,4,6-trichlorophenyl)furan
CID 91803022

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromo-6-methylphenyl)furan?
The IUPAC name of 2-(2-bromo-6-methylphenyl)furan (CID 168524558) is 2-(2-bromo-6-methylphenyl)furan.
What is the SMILES notation for 2-(2-bromo-6-methylphenyl)furan?
The canonical SMILES for 2-(2-bromo-6-methylphenyl)furan is Cc1cccc(Br)c1-c1ccco1.
What is the InChIKey of 2-(2-bromo-6-methylphenyl)furan?
The InChIKey is PUWOYESXEUOFNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9BrO/c1-8-4-2-5-9(12)11(8)10-6-3-7-13-10/h2-7H,1H3.
What are the key properties of 2-(2-bromo-6-methylphenyl)furan?
2-(2-bromo-6-methylphenyl)furan has a molecular weight of 237.10 g/mol, XLogP of 4.02, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromo-6-methylphenyl)furan is sourced from PubChem (CID 168524558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).