2-(triethyl-λ4-sulfanyl)phenol

C12H20OS — CID 139364541

IUPAC2-(triethyl-λ4-sulfanyl)phenol
SMILESCCS(CC)(CC)c1ccccc1O
InChIInChI=1S/C12H20OS/c1-4-14(5-2,6-3)12-10-8-7-9-11(12)13/h7-10,13H,4-6H2,1-3H3
InChIKeyYARVALDYKWVUAL-UHFFFAOYSA-N
MW212.36 g/mol
LogP3.62
Rot. Bonds4

About 2-(triethyl-λ4-sulfanyl)phenol

2-(triethyl-λ4-sulfanyl)phenol (PubChem CID 139364541) has the molecular formula C12H20OS and a molecular weight of 212.36 g/mol. Its IUPAC name is 2-(triethyl-λ4-sulfanyl)phenol.

Molecular Properties

Compound Name2-(triethyl-λ4-sulfanyl)phenol
PubChem CID139364541
Molecular FormulaC12H20OS
Molecular Weight212.36 g/mol
Exact Mass212.12
IUPAC Name2-(triethyl-λ4-sulfanyl)phenol
SMILESCCS(CC)(CC)c1ccccc1O
InChIInChI=1S/C12H20OS/c1-4-14(5-2,6-3)12-10-8-7-9-11(12)13/h7-10,13H,4-6H2,1-3H3
InChIKeyYARVALDYKWVUAL-UHFFFAOYSA-N
XLogP3.62
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.36
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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2-hydroxybenzenesulfonic acid;N-methylmethanamine
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formaldehyde;2-(2-hydroxyphenyl)sulfonylphenol
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N-[(4-ethylphenyl)methyl]-2-hydroxybenzenesulfonamide
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2-(2-fluoroethylsulfonyl)phenol
CID 84672153
2-(propan-2-ylsulfonimidoyl)phenol
CID 130034492
2-(trifluoromethylsulfonyl)phenol
CID 15731663
2-(4-methylphenyl)sulfonylphenol
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Frequently Asked Questions

What is the IUPAC name of 2-(triethyl-λ4-sulfanyl)phenol?
The IUPAC name of 2-(triethyl-λ4-sulfanyl)phenol (CID 139364541) is 2-(triethyl-λ4-sulfanyl)phenol.
What is the SMILES notation for 2-(triethyl-λ4-sulfanyl)phenol?
The canonical SMILES for 2-(triethyl-λ4-sulfanyl)phenol is CCS(CC)(CC)c1ccccc1O.
What is the InChIKey of 2-(triethyl-λ4-sulfanyl)phenol?
The InChIKey is YARVALDYKWVUAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20OS/c1-4-14(5-2,6-3)12-10-8-7-9-11(12)13/h7-10,13H,4-6H2,1-3H3.
What are the key properties of 2-(triethyl-λ4-sulfanyl)phenol?
2-(triethyl-λ4-sulfanyl)phenol has a molecular weight of 212.36 g/mol, XLogP of 3.62, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(triethyl-λ4-sulfanyl)phenol is sourced from PubChem (CID 139364541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).