(4-bromo-3-chlorophenyl)-(furan-2-yl)methanol

C11H8BrClO2 — CID 115797505

IUPAC(4-bromo-3-chlorophenyl)-(furan-2-yl)methanol
SMILESOC(c1ccc(Br)c(Cl)c1)c1ccco1
InChIInChI=1S/C11H8BrClO2/c12-8-4-3-7(6-9(8)13)11(14)10-2-1-5-15-10/h1-6,11,14H
InChIKeySSRLSSHTGMHMON-UHFFFAOYSA-N
MW287.54 g/mol
LogP3.78
Rot. Bonds2

About (4-bromo-3-chlorophenyl)-(furan-2-yl)methanol

(4-bromo-3-chlorophenyl)-(furan-2-yl)methanol (PubChem CID 115797505) has the molecular formula C11H8BrClO2 and a molecular weight of 287.54 g/mol. Its IUPAC name is (4-bromo-3-chlorophenyl)-(furan-2-yl)methanol.

Molecular Properties

Compound Name(4-bromo-3-chlorophenyl)-(furan-2-yl)methanol
PubChem CID115797505
Molecular FormulaC11H8BrClO2
Molecular Weight287.54 g/mol
Exact Mass285.94
IUPAC Name(4-bromo-3-chlorophenyl)-(furan-2-yl)methanol
SMILESOC(c1ccc(Br)c(Cl)c1)c1ccco1
InChIInChI=1S/C11H8BrClO2/c12-8-4-3-7(6-9(8)13)11(14)10-2-1-5-15-10/h1-6,11,14H
InChIKeySSRLSSHTGMHMON-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

(S)-(3-chloro-4-fluorophenyl)-(furan-2-yl)methanol
CID 95256736
[4-bromo-3-(trifluoromethyl)phenyl]-(furan-2-yl)methanol
CID 115797407
N-[(4-bromo-3-chlorophenyl)-(furan-2-yl)methyl]propan-1-amine
CID 81290836
(4-bromo-3-chlorophenyl)-(3-chloro-4-methylphenyl)methanol
CID 107562230
(4-bromo-3-chlorophenyl)-(2,3-dihydrofuran-5-yl)methanol
CID 102653924
(4-bromo-3-chlorophenyl)-(2,3,4,5,6-pentamethylphenyl)methanol
CID 81293215
(3-chloro-4,5-dimethoxyphenyl)-(furan-2-yl)methanol
CID 63947956
(3-bromofuran-2-yl)-(3,4-dichlorophenyl)methanol
CID 63943199
(4-bromo-3-chlorophenyl)-(4-bromo-5-chlorothiophen-2-yl)methanol
CID 102835178
(4-bromo-3-chlorophenyl)-(2,3,5,6-tetramethylphenyl)methanol
CID 81294910
(R)-(4-fluoro-3-methylphenyl)-(furan-2-yl)methanol
CID 94602014
(3-bromo-4-chlorophenyl)-(furan-2-yl)methanamine
CID 115566693

Frequently Asked Questions

What is the IUPAC name of (4-bromo-3-chlorophenyl)-(furan-2-yl)methanol?
The IUPAC name of (4-bromo-3-chlorophenyl)-(furan-2-yl)methanol (CID 115797505) is (4-bromo-3-chlorophenyl)-(furan-2-yl)methanol.
What is the SMILES notation for (4-bromo-3-chlorophenyl)-(furan-2-yl)methanol?
The canonical SMILES for (4-bromo-3-chlorophenyl)-(furan-2-yl)methanol is OC(c1ccc(Br)c(Cl)c1)c1ccco1.
What is the InChIKey of (4-bromo-3-chlorophenyl)-(furan-2-yl)methanol?
The InChIKey is SSRLSSHTGMHMON-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8BrClO2/c12-8-4-3-7(6-9(8)13)11(14)10-2-1-5-15-10/h1-6,11,14H.
What are the key properties of (4-bromo-3-chlorophenyl)-(furan-2-yl)methanol?
(4-bromo-3-chlorophenyl)-(furan-2-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 (4-bromo-3-chlorophenyl)-(furan-2-yl)methanol is sourced from PubChem (CID 115797505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).