2-[(2-hydroxyphenyl)sulfanyl-dimethylstannyl]sulfanylphenol

C14H16O2S2Sn — CID 139686325

IUPAC2-[(2-hydroxyphenyl)sulfanyl-dimethylstannyl]sulfanylphenol
SMILESC[Sn](C)(Sc1ccccc1O)Sc1ccccc1O
InChIInChI=1S/2C6H6OS.2CH3.Sn/c2*7-5-3-1-2-4-6(5)8;;;/h2*1-4,7-8H;2*1H3;/q;;;;+2/p-2
InChIKeySLHKIPLHXZMONV-UHFFFAOYSA-L
MW399.13 g/mol
LogP4.68
Rot. Bonds4

About 2-[(2-hydroxyphenyl)sulfanyl-dimethylstannyl]sulfanylphenol

2-[(2-hydroxyphenyl)sulfanyl-dimethylstannyl]sulfanylphenol (PubChem CID 139686325) has the molecular formula C14H16O2S2Sn and a molecular weight of 399.13 g/mol. Its IUPAC name is 2-[(2-hydroxyphenyl)sulfanyl-dimethylstannyl]sulfanylphenol.

Molecular Properties

Compound Name2-[(2-hydroxyphenyl)sulfanyl-dimethylstannyl]sulfanylphenol
PubChem CID139686325
Molecular FormulaC14H16O2S2Sn
Molecular Weight399.13 g/mol
Exact Mass399.96
IUPAC Name2-[(2-hydroxyphenyl)sulfanyl-dimethylstannyl]sulfanylphenol
SMILESC[Sn](C)(Sc1ccccc1O)Sc1ccccc1O
InChIInChI=1S/2C6H6OS.2CH3.Sn/c2*7-5-3-1-2-4-6(5)8;;;/h2*1-4,7-8H;2*1H3;/q;;;;+2/p-2
InChIKeySLHKIPLHXZMONV-UHFFFAOYSA-L
XLogP4.68
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.13
LogP ≤ 54.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-hydroxyphenyl)sulfanyl-dimethylstannyl]sulfanylphenol?
The IUPAC name of 2-[(2-hydroxyphenyl)sulfanyl-dimethylstannyl]sulfanylphenol (CID 139686325) is 2-[(2-hydroxyphenyl)sulfanyl-dimethylstannyl]sulfanylphenol.
What is the SMILES notation for 2-[(2-hydroxyphenyl)sulfanyl-dimethylstannyl]sulfanylphenol?
The canonical SMILES for 2-[(2-hydroxyphenyl)sulfanyl-dimethylstannyl]sulfanylphenol is C[Sn](C)(Sc1ccccc1O)Sc1ccccc1O.
What is the InChIKey of 2-[(2-hydroxyphenyl)sulfanyl-dimethylstannyl]sulfanylphenol?
The InChIKey is SLHKIPLHXZMONV-UHFFFAOYSA-L. The full InChI is InChI=1S/2C6H6OS.2CH3.Sn/c2*7-5-3-1-2-4-6(5)8;;;/h2*1-4,7-8H;2*1H3;/q;;;;+2/p-2.
What are the key properties of 2-[(2-hydroxyphenyl)sulfanyl-dimethylstannyl]sulfanylphenol?
2-[(2-hydroxyphenyl)sulfanyl-dimethylstannyl]sulfanylphenol has a molecular weight of 399.13 g/mol, XLogP of 4.68, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-hydroxyphenyl)sulfanyl-dimethylstannyl]sulfanylphenol is sourced from PubChem (CID 139686325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).