(R)-(3-chloro-4-fluorophenyl)-(furan-3-yl)methanol

C11H8ClFO2 — CID 95256733

IUPAC(R)-(3-chloro-4-fluorophenyl)-(furan-3-yl)methanol
SMILESO[C@@H](c1ccoc1)c1ccc(F)c(Cl)c1
InChIInChI=1S/C11H8ClFO2/c12-9-5-7(1-2-10(9)13)11(14)8-3-4-15-6-8/h1-6,11,14H/t11-/m1/s1
InChIKeyBISUFHLFXWGIIM-LLVKDONJSA-N
MW226.63 g/mol
LogP3.15
Rot. Bonds2

About (R)-(3-chloro-4-fluorophenyl)-(furan-3-yl)methanol

(R)-(3-chloro-4-fluorophenyl)-(furan-3-yl)methanol (PubChem CID 95256733) has the molecular formula C11H8ClFO2 and a molecular weight of 226.63 g/mol. Its IUPAC name is (R)-(3-chloro-4-fluorophenyl)-(furan-3-yl)methanol.

Molecular Properties

Compound Name(R)-(3-chloro-4-fluorophenyl)-(furan-3-yl)methanol
PubChem CID95256733
Molecular FormulaC11H8ClFO2
Molecular Weight226.63 g/mol
Exact Mass226.02
IUPAC Name(R)-(3-chloro-4-fluorophenyl)-(furan-3-yl)methanol
SMILESO[C@@H](c1ccoc1)c1ccc(F)c(Cl)c1
InChIInChI=1S/C11H8ClFO2/c12-9-5-7(1-2-10(9)13)11(14)8-3-4-15-6-8/h1-6,11,14H/t11-/m1/s1
InChIKeyBISUFHLFXWGIIM-LLVKDONJSA-N
XLogP3.15
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.63
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(S)-(4-fluoro-3-methylphenyl)-(furan-3-yl)methanol
CID 95252370
(4-chloro-3-methylphenyl)-(furan-3-yl)methanol
CID 91636310
(3-bromo-4-chlorophenyl)-(furan-3-yl)methanol
CID 115566408
(3-chloro-4-fluorophenyl)-(4-propan-2-ylphenyl)methanol
CID 63094658
(3-bromo-4-fluorophenyl)-(3-chloro-4-fluorophenyl)methanol
CID 82879548
(S)-(3-chloro-4-fluorophenyl)-(furan-2-yl)methanol
CID 95256736
(S)-(3,5-difluorophenyl)-(furan-3-yl)methanol
CID 95363998
(R)-(3-chloro-4-fluorophenyl)-thiophen-3-ylmethanol
CID 96932942
(3-bromo-5-chlorophenyl)-(furan-3-yl)methanol
CID 107947484
(4-butan-2-ylphenyl)-(3-chloro-4-fluorophenyl)methanol
CID 82879198
(3-chloro-4-fluorophenyl)-(3-fluoro-4-methoxyphenyl)methanol
CID 63094497
(2,6-difluorophenyl)-(furan-3-yl)methanol
CID 63948954

Frequently Asked Questions

What is the IUPAC name of (R)-(3-chloro-4-fluorophenyl)-(furan-3-yl)methanol?
The IUPAC name of (R)-(3-chloro-4-fluorophenyl)-(furan-3-yl)methanol (CID 95256733) is (R)-(3-chloro-4-fluorophenyl)-(furan-3-yl)methanol.
What is the SMILES notation for (R)-(3-chloro-4-fluorophenyl)-(furan-3-yl)methanol?
The canonical SMILES for (R)-(3-chloro-4-fluorophenyl)-(furan-3-yl)methanol is O[C@@H](c1ccoc1)c1ccc(F)c(Cl)c1.
What is the InChIKey of (R)-(3-chloro-4-fluorophenyl)-(furan-3-yl)methanol?
The InChIKey is BISUFHLFXWGIIM-LLVKDONJSA-N. The full InChI is InChI=1S/C11H8ClFO2/c12-9-5-7(1-2-10(9)13)11(14)8-3-4-15-6-8/h1-6,11,14H/t11-/m1/s1.
What are the key properties of (R)-(3-chloro-4-fluorophenyl)-(furan-3-yl)methanol?
(R)-(3-chloro-4-fluorophenyl)-(furan-3-yl)methanol has a molecular weight of 226.63 g/mol, XLogP of 3.15, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-(3-chloro-4-fluorophenyl)-(furan-3-yl)methanol is sourced from PubChem (CID 95256733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).