(4-bromo-3-chlorophenyl)-(furan-3-yl)methanone

C11H6BrClO2 — CID 114971763

IUPAC(4-bromo-3-chlorophenyl)-(furan-3-yl)methanone
SMILESO=C(c1ccoc1)c1ccc(Br)c(Cl)c1
InChIInChI=1S/C11H6BrClO2/c12-9-2-1-7(5-10(9)13)11(14)8-3-4-15-6-8/h1-6H
InChIKeyMORAEHHNRZMEBL-UHFFFAOYSA-N
MW285.52 g/mol
LogP3.93
Rot. Bonds2

About (4-bromo-3-chlorophenyl)-(furan-3-yl)methanone

(4-bromo-3-chlorophenyl)-(furan-3-yl)methanone (PubChem CID 114971763) has the molecular formula C11H6BrClO2 and a molecular weight of 285.52 g/mol. Its IUPAC name is (4-bromo-3-chlorophenyl)-(furan-3-yl)methanone.

Molecular Properties

Compound Name(4-bromo-3-chlorophenyl)-(furan-3-yl)methanone
PubChem CID114971763
Molecular FormulaC11H6BrClO2
Molecular Weight285.52 g/mol
Exact Mass283.92
IUPAC Name(4-bromo-3-chlorophenyl)-(furan-3-yl)methanone
SMILESO=C(c1ccoc1)c1ccc(Br)c(Cl)c1
InChIInChI=1S/C11H6BrClO2/c12-9-2-1-7(5-10(9)13)11(14)8-3-4-15-6-8/h1-6H
InChIKeyMORAEHHNRZMEBL-UHFFFAOYSA-N
XLogP3.93
TPSA30.21 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.52
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(3,4-dichlorophenyl)-[4-(furan-3-carbonyl)piperazin-1-yl]methanone
CID 32530613
6-(4-bromo-3-chlorobenzoyl)-3H-1,3-benzoxazol-2-one
CID 81290552
(3-bromo-2,6-difluorophenyl)-(furan-3-yl)methanone
CID 106941716
(2,5-dibromothiophen-3-yl)-(furan-3-yl)methanone
CID 43463819
(4-bromo-3-chlorophenyl)-(5-bromo-3-methyltriazol-4-yl)methanone
CID 106464396
(4-bromo-3-chlorophenyl)-(2,6-dimethoxyphenyl)methanone
CID 115813439
(4-bromo-3-chlorophenyl)-(7-chloro-1-benzofuran-2-yl)methanone
CID 115810821
(4-bromo-3-chlorophenyl)-quinolin-6-ylmethanone
CID 115790550
(4-bromo-3-chlorophenyl)-(3-bromo-4-propoxyphenyl)methanone
CID 104657090
furan-3-yl-(5-methylfuran-3-yl)methanone
CID 114971729
(4-bromo-3-chlorophenyl)-(2,5-dimethylthiophen-3-yl)methanone
CID 81291094
azocan-1-yl-(4-bromo-3-chlorophenyl)methanone
CID 80979397

Frequently Asked Questions

What is the IUPAC name of (4-bromo-3-chlorophenyl)-(furan-3-yl)methanone?
The IUPAC name of (4-bromo-3-chlorophenyl)-(furan-3-yl)methanone (CID 114971763) is (4-bromo-3-chlorophenyl)-(furan-3-yl)methanone.
What is the SMILES notation for (4-bromo-3-chlorophenyl)-(furan-3-yl)methanone?
The canonical SMILES for (4-bromo-3-chlorophenyl)-(furan-3-yl)methanone is O=C(c1ccoc1)c1ccc(Br)c(Cl)c1.
What is the InChIKey of (4-bromo-3-chlorophenyl)-(furan-3-yl)methanone?
The InChIKey is MORAEHHNRZMEBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H6BrClO2/c12-9-2-1-7(5-10(9)13)11(14)8-3-4-15-6-8/h1-6H.
What are the key properties of (4-bromo-3-chlorophenyl)-(furan-3-yl)methanone?
(4-bromo-3-chlorophenyl)-(furan-3-yl)methanone has a molecular weight of 285.52 g/mol, XLogP of 3.93, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-bromo-3-chlorophenyl)-(furan-3-yl)methanone is sourced from PubChem (CID 114971763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).