2-[4-(4-methylsulfanylphenyl)phenyl]ethanol

C15H16OS — CID 2760093

IUPAC2-[4-(4-methylsulfanylphenyl)phenyl]ethanol
SMILESCSc1ccc(-c2ccc(CCO)cc2)cc1
InChIInChI=1S/C15H16OS/c1-17-15-8-6-14(7-9-15)13-4-2-12(3-5-13)10-11-16/h2-9,16H,10-11H2,1H3
InChIKeyUAMIFPTVMYWSMQ-UHFFFAOYSA-N
MW244.36 g/mol
LogP3.61
Rot. Bonds4

About 2-[4-(4-methylsulfanylphenyl)phenyl]ethanol

2-[4-(4-methylsulfanylphenyl)phenyl]ethanol (PubChem CID 2760093) has the molecular formula C15H16OS and a molecular weight of 244.36 g/mol. Its IUPAC name is 2-[4-(4-methylsulfanylphenyl)phenyl]ethanol.

Molecular Properties

Compound Name2-[4-(4-methylsulfanylphenyl)phenyl]ethanol
PubChem CID2760093
Molecular FormulaC15H16OS
Molecular Weight244.36 g/mol
Exact Mass244.09
IUPAC Name2-[4-(4-methylsulfanylphenyl)phenyl]ethanol
SMILESCSc1ccc(-c2ccc(CCO)cc2)cc1
InChIInChI=1S/C15H16OS/c1-17-15-8-6-14(7-9-15)13-4-2-12(3-5-13)10-11-16/h2-9,16H,10-11H2,1H3
InChIKeyUAMIFPTVMYWSMQ-UHFFFAOYSA-N
XLogP3.61
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.36
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;1-methylsulfanyl-4-(4-methylsulfanylphenyl)benzene
CID 143577780
2-[2-amino-3-(4-methylsulfanylphenyl)phenyl]ethanol
CID 154392985
4-[methyl-[2-(4-methylsulfanylphenyl)ethyl]amino]butan-1-ol
CID 115217902
3-(4-methylsulfanylphenyl)bicyclo[3.1.0]hexa-1(6),2,4-triene
CID 57273599
1-methyl-4-[4-(4-methylsulfanylphenyl)phenyl]benzene
CID 130214671
1-(3-bromopropyl)-4-methylsulfanylbenzene
CID 53433990
1,4-bis(methylsulfanyl)benzene;methanol
CID 143321779
1-ethyl-4-methylsulfanylbenzene
CID 142218139
CID 10662394
CID 10662394
1-methylsulfanyl-4-[(4-phenylphenyl)sulfanylmethyl]benzene
CID 130199319
2-(4-methyliminophosphanylsulfanylphenyl)ethanol
CID 20596248
4-(4-methylsulfanylphenyl)butan-1-amine
CID 10559771

Frequently Asked Questions

What is the IUPAC name of 2-[4-(4-methylsulfanylphenyl)phenyl]ethanol?
The IUPAC name of 2-[4-(4-methylsulfanylphenyl)phenyl]ethanol (CID 2760093) is 2-[4-(4-methylsulfanylphenyl)phenyl]ethanol.
What is the SMILES notation for 2-[4-(4-methylsulfanylphenyl)phenyl]ethanol?
The canonical SMILES for 2-[4-(4-methylsulfanylphenyl)phenyl]ethanol is CSc1ccc(-c2ccc(CCO)cc2)cc1.
What is the InChIKey of 2-[4-(4-methylsulfanylphenyl)phenyl]ethanol?
The InChIKey is UAMIFPTVMYWSMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16OS/c1-17-15-8-6-14(7-9-15)13-4-2-12(3-5-13)10-11-16/h2-9,16H,10-11H2,1H3.
What are the key properties of 2-[4-(4-methylsulfanylphenyl)phenyl]ethanol?
2-[4-(4-methylsulfanylphenyl)phenyl]ethanol has a molecular weight of 244.36 g/mol, XLogP of 3.61, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(4-methylsulfanylphenyl)phenyl]ethanol is sourced from PubChem (CID 2760093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).