(4-bromophenyl)-(7-chloro-1-benzofuran-2-yl)methanol

C15H10BrClO2 — CID 114723321

IUPAC(4-bromophenyl)-(7-chloro-1-benzofuran-2-yl)methanol
SMILESOC(c1ccc(Br)cc1)c1cc2cccc(Cl)c2o1
InChIInChI=1S/C15H10BrClO2/c16-11-6-4-9(5-7-11)14(18)13-8-10-2-1-3-12(17)15(10)19-13/h1-8,14,18H
InChIKeyKPCIPQGFJQPUES-UHFFFAOYSA-N
MW337.60 g/mol
LogP4.93
Rot. Bonds2

About (4-bromophenyl)-(7-chloro-1-benzofuran-2-yl)methanol

(4-bromophenyl)-(7-chloro-1-benzofuran-2-yl)methanol (PubChem CID 114723321) has the molecular formula C15H10BrClO2 and a molecular weight of 337.60 g/mol. Its IUPAC name is (4-bromophenyl)-(7-chloro-1-benzofuran-2-yl)methanol.

Molecular Properties

Compound Name(4-bromophenyl)-(7-chloro-1-benzofuran-2-yl)methanol
PubChem CID114723321
Molecular FormulaC15H10BrClO2
Molecular Weight337.60 g/mol
Exact Mass335.96
IUPAC Name(4-bromophenyl)-(7-chloro-1-benzofuran-2-yl)methanol
SMILESOC(c1ccc(Br)cc1)c1cc2cccc(Cl)c2o1
InChIInChI=1S/C15H10BrClO2/c16-11-6-4-9(5-7-11)14(18)13-8-10-2-1-3-12(17)15(10)19-13/h1-8,14,18H
InChIKeyKPCIPQGFJQPUES-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

(7-chloro-1-benzofuran-2-yl)-(4-cyclopropylphenyl)methanol
CID 114724261
(7-chloro-1-benzofuran-2-yl)-(3,4,5-trifluorophenyl)methanol
CID 114723619
(5-bromo-2-pyridinyl)-(7-chloro-1-benzofuran-2-yl)methanol
CID 114724758
(5-bromo-2-methoxyphenyl)-(7-chloro-1-benzofuran-2-yl)methanol
CID 114723276
(7-chloro-1-benzofuran-2-yl)-(6-methyl-3-pyridinyl)methanol
CID 114724795
(7-chloro-1-benzofuran-2-yl)-(2-chloro-3-fluorophenyl)methanol
CID 115837553
(2-bromo-5-fluorophenyl)-(7-chloro-1-benzofuran-2-yl)methanol
CID 115837557
(7-chloro-1-benzofuran-2-yl)-(2-methoxyphenyl)methanol
CID 114723264
(7-chloro-1-benzofuran-2-yl)-(3-ethoxyphenyl)methanol
CID 114723288
1-(7-chloro-1-benzofuran-2-yl)-2-methylpropan-1-ol
CID 65426322
2-(3-bromobutan-2-yl)-7-chloro-1-benzofuran
CID 114732847
(3,4-dichlorophenyl)-(7-methyl-1-benzofuran-2-yl)methanol
CID 114723344

Frequently Asked Questions

What is the IUPAC name of (4-bromophenyl)-(7-chloro-1-benzofuran-2-yl)methanol?
The IUPAC name of (4-bromophenyl)-(7-chloro-1-benzofuran-2-yl)methanol (CID 114723321) is (4-bromophenyl)-(7-chloro-1-benzofuran-2-yl)methanol.
What is the SMILES notation for (4-bromophenyl)-(7-chloro-1-benzofuran-2-yl)methanol?
The canonical SMILES for (4-bromophenyl)-(7-chloro-1-benzofuran-2-yl)methanol is OC(c1ccc(Br)cc1)c1cc2cccc(Cl)c2o1.
What is the InChIKey of (4-bromophenyl)-(7-chloro-1-benzofuran-2-yl)methanol?
The InChIKey is KPCIPQGFJQPUES-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10BrClO2/c16-11-6-4-9(5-7-11)14(18)13-8-10-2-1-3-12(17)15(10)19-13/h1-8,14,18H.
What are the key properties of (4-bromophenyl)-(7-chloro-1-benzofuran-2-yl)methanol?
(4-bromophenyl)-(7-chloro-1-benzofuran-2-yl)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 (4-bromophenyl)-(7-chloro-1-benzofuran-2-yl)methanol is sourced from PubChem (CID 114723321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).