(3,4-difluorophenyl)-thiophen-2-ylmethanol

C11H8F2OS — CID 61104574

IUPAC(3,4-difluorophenyl)-thiophen-2-ylmethanol
SMILESOC(c1ccc(F)c(F)c1)c1cccs1
InChIInChI=1S/C11H8F2OS/c12-8-4-3-7(6-9(8)13)11(14)10-2-1-5-15-10/h1-6,11,14H
InChIKeySNOOUWVFYNZMLC-UHFFFAOYSA-N
MW226.25 g/mol
LogP3.11
Rot. Bonds2

About (3,4-difluorophenyl)-thiophen-2-ylmethanol

(3,4-difluorophenyl)-thiophen-2-ylmethanol (PubChem CID 61104574) has the molecular formula C11H8F2OS and a molecular weight of 226.25 g/mol. Its IUPAC name is (3,4-difluorophenyl)-thiophen-2-ylmethanol.

Molecular Properties

Compound Name(3,4-difluorophenyl)-thiophen-2-ylmethanol
PubChem CID61104574
Molecular FormulaC11H8F2OS
Molecular Weight226.25 g/mol
Exact Mass226.03
IUPAC Name(3,4-difluorophenyl)-thiophen-2-ylmethanol
SMILESOC(c1ccc(F)c(F)c1)c1cccs1
InChIInChI=1S/C11H8F2OS/c12-8-4-3-7(6-9(8)13)11(14)10-2-1-5-15-10/h1-6,11,14H
InChIKeySNOOUWVFYNZMLC-UHFFFAOYSA-N
XLogP3.11
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.25
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3,4-difluorophenyl)-thiophen-2-ylmethanol?
The IUPAC name of (3,4-difluorophenyl)-thiophen-2-ylmethanol (CID 61104574) is (3,4-difluorophenyl)-thiophen-2-ylmethanol.
What is the SMILES notation for (3,4-difluorophenyl)-thiophen-2-ylmethanol?
The canonical SMILES for (3,4-difluorophenyl)-thiophen-2-ylmethanol is OC(c1ccc(F)c(F)c1)c1cccs1.
What is the InChIKey of (3,4-difluorophenyl)-thiophen-2-ylmethanol?
The InChIKey is SNOOUWVFYNZMLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8F2OS/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 (3,4-difluorophenyl)-thiophen-2-ylmethanol?
(3,4-difluorophenyl)-thiophen-2-ylmethanol has a molecular weight of 226.25 g/mol, XLogP of 3.11, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3,4-difluorophenyl)-thiophen-2-ylmethanol is sourced from PubChem (CID 61104574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).