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

C12H10F2OS — CID 62608803

IUPAC1-(3,5-difluorophenyl)-2-thiophen-2-ylethanol
SMILESOC(Cc1cccs1)c1cc(F)cc(F)c1
InChIInChI=1S/C12H10F2OS/c13-9-4-8(5-10(14)6-9)12(15)7-11-2-1-3-16-11/h1-6,12,15H,7H2
InChIKeyUMAUXMXRFJDYLM-UHFFFAOYSA-N
MW240.27 g/mol
LogP3.30
Rot. Bonds3

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

1-(3,5-difluorophenyl)-2-thiophen-2-ylethanol (PubChem CID 62608803) has the molecular formula C12H10F2OS and a molecular weight of 240.27 g/mol. Its IUPAC name is 1-(3,5-difluorophenyl)-2-thiophen-2-ylethanol.

Molecular Properties

Compound Name1-(3,5-difluorophenyl)-2-thiophen-2-ylethanol
PubChem CID62608803
Molecular FormulaC12H10F2OS
Molecular Weight240.27 g/mol
Exact Mass240.04
IUPAC Name1-(3,5-difluorophenyl)-2-thiophen-2-ylethanol
SMILESOC(Cc1cccs1)c1cc(F)cc(F)c1
InChIInChI=1S/C12H10F2OS/c13-9-4-8(5-10(14)6-9)12(15)7-11-2-1-3-16-11/h1-6,12,15H,7H2
InChIKeyUMAUXMXRFJDYLM-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-thiophen-2-yl-1-(2,4,6-trifluorophenyl)ethanol
CID 65100301
1-(2,6-dimethyl-4-pyridinyl)-2-thiophen-2-ylethanol
CID 107502914
1-(4-fluoro-3-methylphenyl)-2-thiophen-2-ylethanol
CID 62607449
1-(2,5-difluorophenyl)-2-thiophen-2-ylethanol
CID 62802428
1-(3-aminophenyl)-2-thiophen-2-ylethanol
CID 106695892
1-(5-chlorothiophen-3-yl)-2-thiophen-2-ylethanol
CID 130767599
1-(2-fluorophenyl)-2-thiophen-2-ylethanol
CID 62501519
1-(4-phenylphenyl)-2-thiophen-2-ylethanol
CID 65148567
1-[4-(difluoromethoxy)phenyl]-2-thiophen-2-ylethanol
CID 55151573
7-fluoro-5-(1-hydroxy-2-thiophen-2-ylethyl)-1,3-dihydroindol-2-one
CID 82173542
4-(1-hydroxy-2-thiophen-2-ylethyl)benzonitrile
CID 115481022
1-(4-methoxyphenyl)-2-thiophen-2-ylethanol
CID 62501005

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-difluorophenyl)-2-thiophen-2-ylethanol?
The IUPAC name of 1-(3,5-difluorophenyl)-2-thiophen-2-ylethanol (CID 62608803) is 1-(3,5-difluorophenyl)-2-thiophen-2-ylethanol.
What is the SMILES notation for 1-(3,5-difluorophenyl)-2-thiophen-2-ylethanol?
The canonical SMILES for 1-(3,5-difluorophenyl)-2-thiophen-2-ylethanol is OC(Cc1cccs1)c1cc(F)cc(F)c1.
What is the InChIKey of 1-(3,5-difluorophenyl)-2-thiophen-2-ylethanol?
The InChIKey is UMAUXMXRFJDYLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10F2OS/c13-9-4-8(5-10(14)6-9)12(15)7-11-2-1-3-16-11/h1-6,12,15H,7H2.
What are the key properties of 1-(3,5-difluorophenyl)-2-thiophen-2-ylethanol?
1-(3,5-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-(3,5-difluorophenyl)-2-thiophen-2-ylethanol is sourced from PubChem (CID 62608803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).