4-(4-propan-2-yloxyphenyl)sulfanylphenol

C15H16O2S — CID 134238936

IUPAC4-(4-propan-2-yloxyphenyl)sulfanylphenol
SMILESCC(C)Oc1ccc(Sc2ccc(O)cc2)cc1
InChIInChI=1S/C15H16O2S/c1-11(2)17-13-5-9-15(10-6-13)18-14-7-3-12(16)4-8-14/h3-11,16H,1-2H3
InChIKeyKOPLKVBBUJVBDK-UHFFFAOYSA-N
MW260.36 g/mol
LogP4.33
Rot. Bonds4

About 4-(4-propan-2-yloxyphenyl)sulfanylphenol

4-(4-propan-2-yloxyphenyl)sulfanylphenol (PubChem CID 134238936) has the molecular formula C15H16O2S and a molecular weight of 260.36 g/mol. Its IUPAC name is 4-(4-propan-2-yloxyphenyl)sulfanylphenol.

Molecular Properties

Compound Name4-(4-propan-2-yloxyphenyl)sulfanylphenol
PubChem CID134238936
Molecular FormulaC15H16O2S
Molecular Weight260.36 g/mol
Exact Mass260.09
IUPAC Name4-(4-propan-2-yloxyphenyl)sulfanylphenol
SMILESCC(C)Oc1ccc(Sc2ccc(O)cc2)cc1
InChIInChI=1S/C15H16O2S/c1-11(2)17-13-5-9-15(10-6-13)18-14-7-3-12(16)4-8-14/h3-11,16H,1-2H3
InChIKeyKOPLKVBBUJVBDK-UHFFFAOYSA-N
XLogP4.33
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.36
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ethane;4-propan-2-yloxyphenol
CID 142348653
1-bromo-4-(4-propan-2-yloxyphenyl)sulfanylbenzene
CID 137385958
4-[2-(4-propan-2-yloxyphenyl)propan-2-yl]phenol
CID 21466220
4-ethenylphenol;1-ethenyl-4-propan-2-yloxybenzene
CID 67420429
S-(4-propan-2-yloxyphenyl)thiohydroxylamine
CID 117033766
4-[[(4-propan-2-yloxyphenyl)methylamino]methyl]phenol
CID 115581451
2-(4-hydroxyphenyl)sulfanyl-5-methoxyphenol
CID 91879746
2-methyl-2-(4-propan-2-yloxyphenyl)sulfanylpropan-1-ol
CID 116852304
4-[2-[(4-propan-2-yloxyphenyl)methylamino]ethyl]phenol
CID 61236557
trichloro-(4-propan-2-yloxyphenyl)silane
CID 69462595
2-(4-propan-2-yloxyphenyl)sulfanylethanethiol
CID 117033741
2,5-di(propan-2-yloxy)phenol
CID 57426094

Frequently Asked Questions

What is the IUPAC name of 4-(4-propan-2-yloxyphenyl)sulfanylphenol?
The IUPAC name of 4-(4-propan-2-yloxyphenyl)sulfanylphenol (CID 134238936) is 4-(4-propan-2-yloxyphenyl)sulfanylphenol.
What is the SMILES notation for 4-(4-propan-2-yloxyphenyl)sulfanylphenol?
The canonical SMILES for 4-(4-propan-2-yloxyphenyl)sulfanylphenol is CC(C)Oc1ccc(Sc2ccc(O)cc2)cc1.
What is the InChIKey of 4-(4-propan-2-yloxyphenyl)sulfanylphenol?
The InChIKey is KOPLKVBBUJVBDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O2S/c1-11(2)17-13-5-9-15(10-6-13)18-14-7-3-12(16)4-8-14/h3-11,16H,1-2H3.
What are the key properties of 4-(4-propan-2-yloxyphenyl)sulfanylphenol?
4-(4-propan-2-yloxyphenyl)sulfanylphenol has a molecular weight of 260.36 g/mol, XLogP of 4.33, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-propan-2-yloxyphenyl)sulfanylphenol is sourced from PubChem (CID 134238936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).