1-benzofuran-2-yl-(2-bromo-5-chlorophenyl)methanol

C15H10BrClO2 — CID 114724178

IUPAC1-benzofuran-2-yl-(2-bromo-5-chlorophenyl)methanol
SMILESOC(c1cc2ccccc2o1)c1cc(Cl)ccc1Br
InChIInChI=1S/C15H10BrClO2/c16-12-6-5-10(17)8-11(12)15(18)14-7-9-3-1-2-4-13(9)19-14/h1-8,15,18H
InChIKeyWTOGSTNDHAMKTF-UHFFFAOYSA-N
MW337.60 g/mol
LogP4.93
Rot. Bonds2

About 1-benzofuran-2-yl-(2-bromo-5-chlorophenyl)methanol

1-benzofuran-2-yl-(2-bromo-5-chlorophenyl)methanol (PubChem CID 114724178) has the molecular formula C15H10BrClO2 and a molecular weight of 337.60 g/mol. Its IUPAC name is 1-benzofuran-2-yl-(2-bromo-5-chlorophenyl)methanol.

Molecular Properties

Compound Name1-benzofuran-2-yl-(2-bromo-5-chlorophenyl)methanol
PubChem CID114724178
Molecular FormulaC15H10BrClO2
Molecular Weight337.60 g/mol
Exact Mass335.96
IUPAC Name1-benzofuran-2-yl-(2-bromo-5-chlorophenyl)methanol
SMILESOC(c1cc2ccccc2o1)c1cc(Cl)ccc1Br
InChIInChI=1S/C15H10BrClO2/c16-12-6-5-10(17)8-11(12)15(18)14-7-9-3-1-2-4-13(9)19-14/h1-8,15,18H
InChIKeyWTOGSTNDHAMKTF-UHFFFAOYSA-N
XLogP4.93
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.60
LogP ≤ 54.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3-bromo-2-chlorophenyl)-(5-chloro-1-benzofuran-2-yl)methanol
CID 115836547
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CID 114885782
1-benzofuran-2-yl-(3-chloro-2-methylphenyl)methanol
CID 107103499
1-benzofuran-2-yl-(4-bromo-2,6-difluorophenyl)methanol
CID 115836064
1-benzofuran-2-yl-(3,4-difluorophenyl)methanol
CID 63089375
1-benzofuran-2-yl-(5-bromothiophen-3-yl)methanol
CID 105128806
(2-bromo-5-fluorophenyl)-(7-chloro-1-benzofuran-2-yl)methanol
CID 115837557
(2-bromo-5-chlorophenyl)-quinolin-8-ylmethanol
CID 81215844
1-benzofuran-2-yl-(2-cyclopropylphenyl)methanol
CID 114724251
1-benzofuran-2-yl-(4-bromo-1-methylpyrazol-5-yl)methanol
CID 114635081
1-benzofuran-2-yl-(4-bromo-3-chloro-2-fluorophenyl)methanamine
CID 106762492
1-benzofuran-2-yl-(7-fluoro-1-benzofuran-2-yl)methanol
CID 114723565

Frequently Asked Questions

What is the IUPAC name of 1-benzofuran-2-yl-(2-bromo-5-chlorophenyl)methanol?
The IUPAC name of 1-benzofuran-2-yl-(2-bromo-5-chlorophenyl)methanol (CID 114724178) is 1-benzofuran-2-yl-(2-bromo-5-chlorophenyl)methanol.
What is the SMILES notation for 1-benzofuran-2-yl-(2-bromo-5-chlorophenyl)methanol?
The canonical SMILES for 1-benzofuran-2-yl-(2-bromo-5-chlorophenyl)methanol is OC(c1cc2ccccc2o1)c1cc(Cl)ccc1Br.
What is the InChIKey of 1-benzofuran-2-yl-(2-bromo-5-chlorophenyl)methanol?
The InChIKey is WTOGSTNDHAMKTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10BrClO2/c16-12-6-5-10(17)8-11(12)15(18)14-7-9-3-1-2-4-13(9)19-14/h1-8,15,18H.
What are the key properties of 1-benzofuran-2-yl-(2-bromo-5-chlorophenyl)methanol?
1-benzofuran-2-yl-(2-bromo-5-chlorophenyl)methanol has a molecular weight of 337.60 g/mol, XLogP of 4.93, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzofuran-2-yl-(2-bromo-5-chlorophenyl)methanol is sourced from PubChem (CID 114724178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).