2-(3,5-difluorophenyl)-1-thiophen-3-ylethanol

C12H10F2OS — CID 65099650

IUPAC2-(3,5-difluorophenyl)-1-thiophen-3-ylethanol
SMILESOC(Cc1cc(F)cc(F)c1)c1ccsc1
InChIInChI=1S/C12H10F2OS/c13-10-3-8(4-11(14)6-10)5-12(15)9-1-2-16-7-9/h1-4,6-7,12,15H,5H2
InChIKeyUDGKSZGWPTWNBA-UHFFFAOYSA-N
MW240.27 g/mol
LogP3.30
Rot. Bonds3

About 2-(3,5-difluorophenyl)-1-thiophen-3-ylethanol

2-(3,5-difluorophenyl)-1-thiophen-3-ylethanol (PubChem CID 65099650) has the molecular formula C12H10F2OS and a molecular weight of 240.27 g/mol. Its IUPAC name is 2-(3,5-difluorophenyl)-1-thiophen-3-ylethanol.

Molecular Properties

Compound Name2-(3,5-difluorophenyl)-1-thiophen-3-ylethanol
PubChem CID65099650
Molecular FormulaC12H10F2OS
Molecular Weight240.27 g/mol
Exact Mass240.04
IUPAC Name2-(3,5-difluorophenyl)-1-thiophen-3-ylethanol
SMILESOC(Cc1cc(F)cc(F)c1)c1ccsc1
InChIInChI=1S/C12H10F2OS/c13-10-3-8(4-11(14)6-10)5-12(15)9-1-2-16-7-9/h1-4,6-7,12,15H,5H2
InChIKeyUDGKSZGWPTWNBA-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

2-(4-bromophenyl)-1-thiophen-3-ylethanol
CID 60797618
1-(3-fluorophenyl)-2-thiophen-3-ylethanol
CID 62607958
2-[[3-fluoro-5-(trifluoromethyl)phenyl]methylamino]-1-thiophen-3-ylethanol
CID 103823528
2-(3,5-difluorophenyl)-1-[4-(methoxymethyl)phenyl]ethanol
CID 105402605
N-benzyl-3,5-difluoro-N-(2-hydroxy-2-thiophen-3-ylethyl)benzamide
CID 71854734
2-(3-bromo-5-fluorophenyl)-1-(3,5-difluorophenyl)ethanol
CID 79703067
4,4,4-trifluoro-1-thiophen-3-ylbutan-1-ol
CID 64565518
2-(3,5-difluorophenyl)-1-(4-propylphenyl)ethanol
CID 62800447
3-[2-chloro-2-(3,5-difluorophenyl)ethyl]thiophene
CID 63016253
1-(3-bromo-4-fluorophenyl)-2-thiophen-3-ylethanol
CID 65148445
1-(3-chloro-4-fluorophenyl)-2-thiophen-3-ylethanol
CID 63094329
3-amino-1-thiophen-3-ylpropan-1-ol
CID 65185005

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-difluorophenyl)-1-thiophen-3-ylethanol?
The IUPAC name of 2-(3,5-difluorophenyl)-1-thiophen-3-ylethanol (CID 65099650) is 2-(3,5-difluorophenyl)-1-thiophen-3-ylethanol.
What is the SMILES notation for 2-(3,5-difluorophenyl)-1-thiophen-3-ylethanol?
The canonical SMILES for 2-(3,5-difluorophenyl)-1-thiophen-3-ylethanol is OC(Cc1cc(F)cc(F)c1)c1ccsc1.
What is the InChIKey of 2-(3,5-difluorophenyl)-1-thiophen-3-ylethanol?
The InChIKey is UDGKSZGWPTWNBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10F2OS/c13-10-3-8(4-11(14)6-10)5-12(15)9-1-2-16-7-9/h1-4,6-7,12,15H,5H2.
What are the key properties of 2-(3,5-difluorophenyl)-1-thiophen-3-ylethanol?
2-(3,5-difluorophenyl)-1-thiophen-3-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 2-(3,5-difluorophenyl)-1-thiophen-3-ylethanol is sourced from PubChem (CID 65099650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).