(3-fluorothiophen-2-yl)-(furan-3-yl)methanol

C9H7FO2S — CID 130594727

IUPAC(3-fluorothiophen-2-yl)-(furan-3-yl)methanol
SMILESOC(c1ccoc1)c1sccc1F
InChIInChI=1S/C9H7FO2S/c10-7-2-4-13-9(7)8(11)6-1-3-12-5-6/h1-5,8,11H
InChIKeyZLMTXYIPDRKFLU-UHFFFAOYSA-N
MW198.22 g/mol
LogP2.56
Rot. Bonds2

About (3-fluorothiophen-2-yl)-(furan-3-yl)methanol

(3-fluorothiophen-2-yl)-(furan-3-yl)methanol (PubChem CID 130594727) has the molecular formula C9H7FO2S and a molecular weight of 198.22 g/mol. Its IUPAC name is (3-fluorothiophen-2-yl)-(furan-3-yl)methanol.

Molecular Properties

Compound Name(3-fluorothiophen-2-yl)-(furan-3-yl)methanol
PubChem CID130594727
Molecular FormulaC9H7FO2S
Molecular Weight198.22 g/mol
Exact Mass198.02
IUPAC Name(3-fluorothiophen-2-yl)-(furan-3-yl)methanol
SMILESOC(c1ccoc1)c1sccc1F
InChIInChI=1S/C9H7FO2S/c10-7-2-4-13-9(7)8(11)6-1-3-12-5-6/h1-5,8,11H
InChIKeyZLMTXYIPDRKFLU-UHFFFAOYSA-N
XLogP2.56
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.22
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3-fluorothiophen-2-yl)-(furan-3-yl)methanol?
The IUPAC name of (3-fluorothiophen-2-yl)-(furan-3-yl)methanol (CID 130594727) is (3-fluorothiophen-2-yl)-(furan-3-yl)methanol.
What is the SMILES notation for (3-fluorothiophen-2-yl)-(furan-3-yl)methanol?
The canonical SMILES for (3-fluorothiophen-2-yl)-(furan-3-yl)methanol is OC(c1ccoc1)c1sccc1F.
What is the InChIKey of (3-fluorothiophen-2-yl)-(furan-3-yl)methanol?
The InChIKey is ZLMTXYIPDRKFLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7FO2S/c10-7-2-4-13-9(7)8(11)6-1-3-12-5-6/h1-5,8,11H.
What are the key properties of (3-fluorothiophen-2-yl)-(furan-3-yl)methanol?
(3-fluorothiophen-2-yl)-(furan-3-yl)methanol has a molecular weight of 198.22 g/mol, XLogP of 2.56, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluorothiophen-2-yl)-(furan-3-yl)methanol is sourced from PubChem (CID 130594727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).