2-(3-bromothiophen-2-yl)-1-thiophen-3-ylethanol

C10H9BrOS2 — CID 62606491

IUPAC2-(3-bromothiophen-2-yl)-1-thiophen-3-ylethanol
SMILESOC(Cc1sccc1Br)c1ccsc1
InChIInChI=1S/C10H9BrOS2/c11-8-2-4-14-10(8)5-9(12)7-1-3-13-6-7/h1-4,6,9,12H,5H2
InChIKeyLAHFIBIJYPIVCP-UHFFFAOYSA-N
MW289.22 g/mol
LogP3.85
Rot. Bonds3

About 2-(3-bromothiophen-2-yl)-1-thiophen-3-ylethanol

2-(3-bromothiophen-2-yl)-1-thiophen-3-ylethanol (PubChem CID 62606491) has the molecular formula C10H9BrOS2 and a molecular weight of 289.22 g/mol. Its IUPAC name is 2-(3-bromothiophen-2-yl)-1-thiophen-3-ylethanol.

Molecular Properties

Compound Name2-(3-bromothiophen-2-yl)-1-thiophen-3-ylethanol
PubChem CID62606491
Molecular FormulaC10H9BrOS2
Molecular Weight289.22 g/mol
Exact Mass287.93
IUPAC Name2-(3-bromothiophen-2-yl)-1-thiophen-3-ylethanol
SMILESOC(Cc1sccc1Br)c1ccsc1
InChIInChI=1S/C10H9BrOS2/c11-8-2-4-14-10(8)5-9(12)7-1-3-13-6-7/h1-4,6,9,12H,5H2
InChIKeyLAHFIBIJYPIVCP-UHFFFAOYSA-N
XLogP3.85
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.22
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-bromo-3,5-dimethylphenyl)-2-(3-bromothiophen-2-yl)ethanol
CID 114329930
2-(4-bromophenyl)-1-thiophen-3-ylethanol
CID 60797618
1-(4-bromo-3-chlorophenyl)-2-(3-bromothiophen-2-yl)ethanol
CID 115790843
N-[2-(3-bromothiophen-2-yl)-1-thiophen-3-ylethyl]propan-1-amine
CID 62602066
2-(3-bromothiophen-2-yl)-1-(1,2,5-thiadiazol-3-yl)ethanol
CID 105090888
2-(3-bromothiophen-2-yl)-1-(3,4-dimethoxyphenyl)ethanol
CID 62606656
2-(3-bromothiophen-2-yl)-1-(4-methyl-1,3-thiazol-2-yl)ethanol
CID 104769527
2-(3-bromothiophen-2-yl)-1-(2,4-dimethylphenyl)ethanol
CID 65148432
2-(3-bromothiophen-2-yl)-1-(3-cyclopropylphenyl)ethanol
CID 79980714
2-(3-bromothiophen-2-yl)-1-[3-(trifluoromethoxy)phenyl]ethanol
CID 107104973
1-(5-bromo-2-methylphenyl)-2-(3-bromothiophen-2-yl)ethanol
CID 115790767
2-(3,5-difluorophenyl)-1-thiophen-3-ylethanol
CID 65099650

Frequently Asked Questions

What is the IUPAC name of 2-(3-bromothiophen-2-yl)-1-thiophen-3-ylethanol?
The IUPAC name of 2-(3-bromothiophen-2-yl)-1-thiophen-3-ylethanol (CID 62606491) is 2-(3-bromothiophen-2-yl)-1-thiophen-3-ylethanol.
What is the SMILES notation for 2-(3-bromothiophen-2-yl)-1-thiophen-3-ylethanol?
The canonical SMILES for 2-(3-bromothiophen-2-yl)-1-thiophen-3-ylethanol is OC(Cc1sccc1Br)c1ccsc1.
What is the InChIKey of 2-(3-bromothiophen-2-yl)-1-thiophen-3-ylethanol?
The InChIKey is LAHFIBIJYPIVCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9BrOS2/c11-8-2-4-14-10(8)5-9(12)7-1-3-13-6-7/h1-4,6,9,12H,5H2.
What are the key properties of 2-(3-bromothiophen-2-yl)-1-thiophen-3-ylethanol?
2-(3-bromothiophen-2-yl)-1-thiophen-3-ylethanol has a molecular weight of 289.22 g/mol, XLogP of 3.85, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-bromothiophen-2-yl)-1-thiophen-3-ylethanol is sourced from PubChem (CID 62606491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).