1-(2,5-difluorophenyl)-2-thiophen-2-ylethanol

C12H10F2OS — CID 62802428

IUPAC1-(2,5-difluorophenyl)-2-thiophen-2-ylethanol
SMILESOC(Cc1cccs1)c1cc(F)ccc1F
InChIInChI=1S/C12H10F2OS/c13-8-3-4-11(14)10(6-8)12(15)7-9-2-1-5-16-9/h1-6,12,15H,7H2
InChIKeyNZLDEJVDTNGGSF-UHFFFAOYSA-N
MW240.27 g/mol
LogP3.30
Rot. Bonds3

About 1-(2,5-difluorophenyl)-2-thiophen-2-ylethanol

1-(2,5-difluorophenyl)-2-thiophen-2-ylethanol (PubChem CID 62802428) has the molecular formula C12H10F2OS and a molecular weight of 240.27 g/mol. Its IUPAC name is 1-(2,5-difluorophenyl)-2-thiophen-2-ylethanol.

Molecular Properties

Compound Name1-(2,5-difluorophenyl)-2-thiophen-2-ylethanol
PubChem CID62802428
Molecular FormulaC12H10F2OS
Molecular Weight240.27 g/mol
Exact Mass240.04
IUPAC Name1-(2,5-difluorophenyl)-2-thiophen-2-ylethanol
SMILESOC(Cc1cccs1)c1cc(F)ccc1F
InChIInChI=1S/C12H10F2OS/c13-8-3-4-11(14)10(6-8)12(15)7-9-2-1-5-16-9/h1-6,12,15H,7H2
InChIKeyNZLDEJVDTNGGSF-UHFFFAOYSA-N
XLogP3.30
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.27
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-fluorophenyl)-2-thiophen-2-ylethanol
CID 62501519
2-thiophen-2-yl-1-(2,4,6-trifluorophenyl)ethanol
CID 65100301
1-(3,5-difluorophenyl)-2-thiophen-2-ylethanol
CID 62608803
1-(2,5-difluorophenyl)-2-phenylethanol
CID 61101479
1-(2,5-difluorophenyl)-2-(4-fluorophenyl)ethanol
CID 61100110
1-(4-fluoro-3-methylphenyl)-2-thiophen-2-ylethanol
CID 62607449
1-(2-fluoro-3-methylphenyl)-2-thiophen-2-ylethanol
CID 81477466
2-(2,5-difluorophenyl)-2-(thiophen-2-ylmethylamino)acetonitrile
CID 54887054
1-(3-chloro-2-fluorophenyl)-2-thiophen-2-ylethanol
CID 64713103
1-(3-bromo-2,6-difluorophenyl)-2-thiophen-2-ylethanol
CID 106941958
1-(2,5-difluorophenyl)-N-(thiophen-2-ylmethyl)ethane-1,2-diamine
CID 65380159
1-(2-fluoro-5-methylphenyl)-4-thiophen-2-ylbutan-1-ol
CID 105094222

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-difluorophenyl)-2-thiophen-2-ylethanol?
The IUPAC name of 1-(2,5-difluorophenyl)-2-thiophen-2-ylethanol (CID 62802428) is 1-(2,5-difluorophenyl)-2-thiophen-2-ylethanol.
What is the SMILES notation for 1-(2,5-difluorophenyl)-2-thiophen-2-ylethanol?
The canonical SMILES for 1-(2,5-difluorophenyl)-2-thiophen-2-ylethanol is OC(Cc1cccs1)c1cc(F)ccc1F.
What is the InChIKey of 1-(2,5-difluorophenyl)-2-thiophen-2-ylethanol?
The InChIKey is NZLDEJVDTNGGSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10F2OS/c13-8-3-4-11(14)10(6-8)12(15)7-9-2-1-5-16-9/h1-6,12,15H,7H2.
What are the key properties of 1-(2,5-difluorophenyl)-2-thiophen-2-ylethanol?
1-(2,5-difluorophenyl)-2-thiophen-2-ylethanol has a molecular weight of 240.27 g/mol, XLogP of 3.30, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-difluorophenyl)-2-thiophen-2-ylethanol is sourced from PubChem (CID 62802428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).