2-(3-bromo-5-chloro-4-ethoxyphenyl)furan

C12H10BrClO2 — CID 168524802

IUPAC2-(3-bromo-5-chloro-4-ethoxyphenyl)furan
SMILESCCOc1c(Cl)cc(-c2ccco2)cc1Br
InChIInChI=1S/C12H10BrClO2/c1-2-15-12-9(13)6-8(7-10(12)14)11-4-3-5-16-11/h3-7H,2H2,1H3
InChIKeyBHHFVIOOIHSFRR-UHFFFAOYSA-N
MW301.57 g/mol
LogP4.76
Rot. Bonds3

About 2-(3-bromo-5-chloro-4-ethoxyphenyl)furan

2-(3-bromo-5-chloro-4-ethoxyphenyl)furan (PubChem CID 168524802) has the molecular formula C12H10BrClO2 and a molecular weight of 301.57 g/mol. Its IUPAC name is 2-(3-bromo-5-chloro-4-ethoxyphenyl)furan.

Molecular Properties

Compound Name2-(3-bromo-5-chloro-4-ethoxyphenyl)furan
PubChem CID168524802
Molecular FormulaC12H10BrClO2
Molecular Weight301.57 g/mol
Exact Mass299.96
IUPAC Name2-(3-bromo-5-chloro-4-ethoxyphenyl)furan
SMILESCCOc1c(Cl)cc(-c2ccco2)cc1Br
InChIInChI=1S/C12H10BrClO2/c1-2-15-12-9(13)6-8(7-10(12)14)11-4-3-5-16-11/h3-7H,2H2,1H3
InChIKeyBHHFVIOOIHSFRR-UHFFFAOYSA-N
XLogP4.76
TPSA22.37 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.57
LogP ≤ 54.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-chloro-4-propoxyphenyl)furan
CID 168525179
2-(3-bromo-5-chloro-4-ethoxyphenyl)-1H-benzimidazole
CID 168554522
N-[(3,5-dibromo-4-ethoxyphenyl)methyl]-1-(furan-2-yl)methanamine;hydrochloride
CID 17158543
2-(3,5-dichlorophenyl)furan
CID 11557556
2-(4-bromo-5-chloro-2-methylphenyl)furan
CID 168524424
2-(5-bromo-2-ethoxyphenyl)furan
CID 168526403
1-bromo-3-chloro-2-ethoxy-5-isocyanatobenzene
CID 169352305
2-(4-chloro-3,5-dimethylphenyl)furan
CID 168527809
N-[(3,5-dichloro-4-ethoxyphenyl)methyl]-1-(furan-2-yl)methanamine
CID 17158546
5-bromo-1-chloro-2-ethoxy-3-nitrobenzene
CID 70699765
2-(2-bromo-4-chloro-5-methoxyphenyl)furan
CID 168525902
2-[(3-bromo-5-chloro-4-ethoxyphenyl)methylidene]indene-1,3-dione
CID 1209448

Frequently Asked Questions

What is the IUPAC name of 2-(3-bromo-5-chloro-4-ethoxyphenyl)furan?
The IUPAC name of 2-(3-bromo-5-chloro-4-ethoxyphenyl)furan (CID 168524802) is 2-(3-bromo-5-chloro-4-ethoxyphenyl)furan.
What is the SMILES notation for 2-(3-bromo-5-chloro-4-ethoxyphenyl)furan?
The canonical SMILES for 2-(3-bromo-5-chloro-4-ethoxyphenyl)furan is CCOc1c(Cl)cc(-c2ccco2)cc1Br.
What is the InChIKey of 2-(3-bromo-5-chloro-4-ethoxyphenyl)furan?
The InChIKey is BHHFVIOOIHSFRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10BrClO2/c1-2-15-12-9(13)6-8(7-10(12)14)11-4-3-5-16-11/h3-7H,2H2,1H3.
What are the key properties of 2-(3-bromo-5-chloro-4-ethoxyphenyl)furan?
2-(3-bromo-5-chloro-4-ethoxyphenyl)furan has a molecular weight of 301.57 g/mol, XLogP of 4.76, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-bromo-5-chloro-4-ethoxyphenyl)furan is sourced from PubChem (CID 168524802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).