2-(4-ethoxy-2,3-difluorophenyl)thiophene

C12H10F2OS — CID 143775731

IUPAC2-(4-ethoxy-2,3-difluorophenyl)thiophene
SMILESCCOc1ccc(-c2cccs2)c(F)c1F
InChIInChI=1S/C12H10F2OS/c1-2-15-9-6-5-8(11(13)12(9)14)10-4-3-7-16-10/h3-7H,2H2,1H3
InChIKeyRPJDCELFELPUOO-UHFFFAOYSA-N
MW240.27 g/mol
LogP4.09
Rot. Bonds3

About 2-(4-ethoxy-2,3-difluorophenyl)thiophene

2-(4-ethoxy-2,3-difluorophenyl)thiophene (PubChem CID 143775731) has the molecular formula C12H10F2OS and a molecular weight of 240.27 g/mol. Its IUPAC name is 2-(4-ethoxy-2,3-difluorophenyl)thiophene.

Molecular Properties

Compound Name2-(4-ethoxy-2,3-difluorophenyl)thiophene
PubChem CID143775731
Molecular FormulaC12H10F2OS
Molecular Weight240.27 g/mol
Exact Mass240.04
IUPAC Name2-(4-ethoxy-2,3-difluorophenyl)thiophene
SMILESCCOc1ccc(-c2cccs2)c(F)c1F
InChIInChI=1S/C12H10F2OS/c1-2-15-9-6-5-8(11(13)12(9)14)10-4-3-7-16-10/h3-7H,2H2,1H3
InChIKeyRPJDCELFELPUOO-UHFFFAOYSA-N
XLogP4.09
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.27
LogP ≤ 54.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-ethoxy-2,3-difluorophenyl)thiophene?
The IUPAC name of 2-(4-ethoxy-2,3-difluorophenyl)thiophene (CID 143775731) is 2-(4-ethoxy-2,3-difluorophenyl)thiophene.
What is the SMILES notation for 2-(4-ethoxy-2,3-difluorophenyl)thiophene?
The canonical SMILES for 2-(4-ethoxy-2,3-difluorophenyl)thiophene is CCOc1ccc(-c2cccs2)c(F)c1F.
What is the InChIKey of 2-(4-ethoxy-2,3-difluorophenyl)thiophene?
The InChIKey is RPJDCELFELPUOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10F2OS/c1-2-15-9-6-5-8(11(13)12(9)14)10-4-3-7-16-10/h3-7H,2H2,1H3.
What are the key properties of 2-(4-ethoxy-2,3-difluorophenyl)thiophene?
2-(4-ethoxy-2,3-difluorophenyl)thiophene has a molecular weight of 240.27 g/mol, XLogP of 4.09, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethoxy-2,3-difluorophenyl)thiophene is sourced from PubChem (CID 143775731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).