(3-bromo-5-chlorophenyl)-(furan-3-yl)methanol

C11H8BrClO2 — CID 107947484

IUPAC(3-bromo-5-chlorophenyl)-(furan-3-yl)methanol
SMILESOC(c1ccoc1)c1cc(Cl)cc(Br)c1
InChIInChI=1S/C11H8BrClO2/c12-9-3-8(4-10(13)5-9)11(14)7-1-2-15-6-7/h1-6,11,14H
InChIKeyLWZSGUROBZEUFY-UHFFFAOYSA-N
MW287.54 g/mol
LogP3.78
Rot. Bonds2

About (3-bromo-5-chlorophenyl)-(furan-3-yl)methanol

(3-bromo-5-chlorophenyl)-(furan-3-yl)methanol (PubChem CID 107947484) has the molecular formula C11H8BrClO2 and a molecular weight of 287.54 g/mol. Its IUPAC name is (3-bromo-5-chlorophenyl)-(furan-3-yl)methanol.

Molecular Properties

Compound Name(3-bromo-5-chlorophenyl)-(furan-3-yl)methanol
PubChem CID107947484
Molecular FormulaC11H8BrClO2
Molecular Weight287.54 g/mol
Exact Mass285.94
IUPAC Name(3-bromo-5-chlorophenyl)-(furan-3-yl)methanol
SMILESOC(c1ccoc1)c1cc(Cl)cc(Br)c1
InChIInChI=1S/C11H8BrClO2/c12-9-3-8(4-10(13)5-9)11(14)7-1-2-15-6-7/h1-6,11,14H
InChIKeyLWZSGUROBZEUFY-UHFFFAOYSA-N
XLogP3.78
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.54
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,2-bis(3-bromo-5-chlorophenyl)ethane-1,2-diol
CID 139745260
(3-bromo-4-chlorophenyl)-(furan-3-yl)methanol
CID 115566408
(R)-(3-chloro-4-fluorophenyl)-(furan-3-yl)methanol
CID 95256733
(S)-(3,5-difluorophenyl)-(furan-3-yl)methanol
CID 95363998
(5-bromothiophen-3-yl)-(furan-3-yl)methanol
CID 105097126
(3-bromo-5-chlorophenyl)-(2-chlorophenyl)methanol
CID 107947286
(5-bromo-4-chlorothiophen-2-yl)-(furan-3-yl)methanol
CID 80532151
(3-bromo-5-chlorophenyl)-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)methanol
CID 107947446
(3-bromo-5-chlorophenyl)-(2,3,4,5,6-pentamethylphenyl)methanol
CID 107955365
(3-bromo-5-chlorophenyl)-(4-propan-2-yloxyphenyl)methanol
CID 107947461
(3-bromo-5-chlorophenyl)-(2,6-difluorophenyl)methanol
CID 114019455
(4-chloro-3-methylphenyl)-(furan-3-yl)methanol
CID 91636310

Frequently Asked Questions

What is the IUPAC name of (3-bromo-5-chlorophenyl)-(furan-3-yl)methanol?
The IUPAC name of (3-bromo-5-chlorophenyl)-(furan-3-yl)methanol (CID 107947484) is (3-bromo-5-chlorophenyl)-(furan-3-yl)methanol.
What is the SMILES notation for (3-bromo-5-chlorophenyl)-(furan-3-yl)methanol?
The canonical SMILES for (3-bromo-5-chlorophenyl)-(furan-3-yl)methanol is OC(c1ccoc1)c1cc(Cl)cc(Br)c1.
What is the InChIKey of (3-bromo-5-chlorophenyl)-(furan-3-yl)methanol?
The InChIKey is LWZSGUROBZEUFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8BrClO2/c12-9-3-8(4-10(13)5-9)11(14)7-1-2-15-6-7/h1-6,11,14H.
What are the key properties of (3-bromo-5-chlorophenyl)-(furan-3-yl)methanol?
(3-bromo-5-chlorophenyl)-(furan-3-yl)methanol has a molecular weight of 287.54 g/mol, XLogP of 3.78, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-bromo-5-chlorophenyl)-(furan-3-yl)methanol is sourced from PubChem (CID 107947484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).