2-(2-chlorophenyl)sulfanyl-1-(5-fluoro-2-methylphenyl)ethanol

C15H14ClFOS — CID 66153341

IUPAC2-(2-chlorophenyl)sulfanyl-1-(5-fluoro-2-methylphenyl)ethanol
SMILESCc1ccc(F)cc1C(O)CSc1ccccc1Cl
InChIInChI=1S/C15H14ClFOS/c1-10-6-7-11(17)8-12(10)14(18)9-19-15-5-3-2-4-13(15)16/h2-8,14,18H,9H2,1H3
InChIKeyJARPAJWQAOUICX-UHFFFAOYSA-N
MW296.79 g/mol
LogP4.61
Rot. Bonds4

About 2-(2-chlorophenyl)sulfanyl-1-(5-fluoro-2-methylphenyl)ethanol

2-(2-chlorophenyl)sulfanyl-1-(5-fluoro-2-methylphenyl)ethanol (PubChem CID 66153341) has the molecular formula C15H14ClFOS and a molecular weight of 296.79 g/mol. Its IUPAC name is 2-(2-chlorophenyl)sulfanyl-1-(5-fluoro-2-methylphenyl)ethanol.

Molecular Properties

Compound Name2-(2-chlorophenyl)sulfanyl-1-(5-fluoro-2-methylphenyl)ethanol
PubChem CID66153341
Molecular FormulaC15H14ClFOS
Molecular Weight296.79 g/mol
Exact Mass296.04
IUPAC Name2-(2-chlorophenyl)sulfanyl-1-(5-fluoro-2-methylphenyl)ethanol
SMILESCc1ccc(F)cc1C(O)CSc1ccccc1Cl
InChIInChI=1S/C15H14ClFOS/c1-10-6-7-11(17)8-12(10)14(18)9-19-15-5-3-2-4-13(15)16/h2-8,14,18H,9H2,1H3
InChIKeyJARPAJWQAOUICX-UHFFFAOYSA-N
XLogP4.61
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.79
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-chlorophenyl)sulfanyl-1-(5-fluoro-2-methylphenyl)ethanol
CID 66148548
1-(5-fluoro-2-methylphenyl)-2-methylsulfanylethanol
CID 62791337
2-[2-(2-chlorophenyl)sulfanyl-1-hydroxyethyl]phenol
CID 66153915
2-(2-chloro-6-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol
CID 62388239
2-(2-chloro-4-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol
CID 62607143
2-(2-chlorophenyl)sulfanyl-1-(2,6-dimethyl-4-pyridinyl)ethanol
CID 107504561
2-(2-chloro-4-methylphenyl)-1-(5-fluoro-2-methylphenyl)ethanol
CID 106867292
[1-(2-chloro-5-fluorophenyl)-2-(2-methylphenyl)sulfanylethyl]hydrazine
CID 105397872
2-(3,4-dichlorophenyl)-1-(5-fluoro-2-methylphenyl)ethanol
CID 62607682
1-(2-bromo-3,4-difluorophenyl)-2-(2-chlorophenyl)sulfanylethanol
CID 107540962
3-amino-2-(2-chlorophenyl)-1-(5-fluoro-2-methylphenyl)propan-1-ol
CID 65184459
[1-(5-fluoro-2-methylphenyl)-2-(2-methylphenyl)sulfanylethyl]hydrazine
CID 105237339

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)sulfanyl-1-(5-fluoro-2-methylphenyl)ethanol?
The IUPAC name of 2-(2-chlorophenyl)sulfanyl-1-(5-fluoro-2-methylphenyl)ethanol (CID 66153341) is 2-(2-chlorophenyl)sulfanyl-1-(5-fluoro-2-methylphenyl)ethanol.
What is the SMILES notation for 2-(2-chlorophenyl)sulfanyl-1-(5-fluoro-2-methylphenyl)ethanol?
The canonical SMILES for 2-(2-chlorophenyl)sulfanyl-1-(5-fluoro-2-methylphenyl)ethanol is Cc1ccc(F)cc1C(O)CSc1ccccc1Cl.
What is the InChIKey of 2-(2-chlorophenyl)sulfanyl-1-(5-fluoro-2-methylphenyl)ethanol?
The InChIKey is JARPAJWQAOUICX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClFOS/c1-10-6-7-11(17)8-12(10)14(18)9-19-15-5-3-2-4-13(15)16/h2-8,14,18H,9H2,1H3.
What are the key properties of 2-(2-chlorophenyl)sulfanyl-1-(5-fluoro-2-methylphenyl)ethanol?
2-(2-chlorophenyl)sulfanyl-1-(5-fluoro-2-methylphenyl)ethanol has a molecular weight of 296.79 g/mol, XLogP of 4.61, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)sulfanyl-1-(5-fluoro-2-methylphenyl)ethanol is sourced from PubChem (CID 66153341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).