2,3-dimethyl-5-thiophen-2-ylphenol

C12H12OS — CID 173292102

IUPAC2,3-dimethyl-5-thiophen-2-ylphenol
SMILESCc1cc(-c2cccs2)cc(O)c1C
InChIInChI=1S/C12H12OS/c1-8-6-10(7-11(13)9(8)2)12-4-3-5-14-12/h3-7,13H,1-2H3
InChIKeyJJYLAHZKBMMZIV-UHFFFAOYSA-N
MW204.29 g/mol
LogP3.74
Rot. Bonds1

About 2,3-dimethyl-5-thiophen-2-ylphenol

2,3-dimethyl-5-thiophen-2-ylphenol (PubChem CID 173292102) has the molecular formula C12H12OS and a molecular weight of 204.29 g/mol. Its IUPAC name is 2,3-dimethyl-5-thiophen-2-ylphenol.

Molecular Properties

Compound Name2,3-dimethyl-5-thiophen-2-ylphenol
PubChem CID173292102
Molecular FormulaC12H12OS
Molecular Weight204.29 g/mol
Exact Mass204.06
IUPAC Name2,3-dimethyl-5-thiophen-2-ylphenol
SMILESCc1cc(-c2cccs2)cc(O)c1C
InChIInChI=1S/C12H12OS/c1-8-6-10(7-11(13)9(8)2)12-4-3-5-14-12/h3-7,13H,1-2H3
InChIKeyJJYLAHZKBMMZIV-UHFFFAOYSA-N
XLogP3.74
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.29
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;2-methyl-4-thiophen-2-ylaniline
CID 143928116
2-[3-(3,5-dithiophen-2-ylphenyl)-5-thiophen-2-ylphenyl]thiophene
CID 25194793
2-amino-3-methyl-5-thiophen-2-ylbenzenethiol
CID 70070727
ethane;2-methyl-4-thiophen-2-ylaniline;molecular hydrogen
CID 143928123
(2-methyl-5-thiophen-2-ylphenyl)hydrazine
CID 54385611
(2-methyl-4-thiophen-2-ylphenyl) acetate
CID 174371049
2-(2-methyl-4-thiophen-2-ylphenoxy)ethanol
CID 143820107
ethane;2-(3-methylphenyl)thiophene
CID 143181554
2-methyl-5-thiophen-2-ylbenzoic acid
CID 65309680
N-(2,6-dimethyl-4-thiophen-2-ylphenyl)benzamide
CID 68907909
4-thiophen-2-ylthiophen-2-ol
CID 154302711
2-chloro-3-methyl-5-thiophen-2-ylpyridine
CID 83814921

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-5-thiophen-2-ylphenol?
The IUPAC name of 2,3-dimethyl-5-thiophen-2-ylphenol (CID 173292102) is 2,3-dimethyl-5-thiophen-2-ylphenol.
What is the SMILES notation for 2,3-dimethyl-5-thiophen-2-ylphenol?
The canonical SMILES for 2,3-dimethyl-5-thiophen-2-ylphenol is Cc1cc(-c2cccs2)cc(O)c1C.
What is the InChIKey of 2,3-dimethyl-5-thiophen-2-ylphenol?
The InChIKey is JJYLAHZKBMMZIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12OS/c1-8-6-10(7-11(13)9(8)2)12-4-3-5-14-12/h3-7,13H,1-2H3.
What are the key properties of 2,3-dimethyl-5-thiophen-2-ylphenol?
2,3-dimethyl-5-thiophen-2-ylphenol has a molecular weight of 204.29 g/mol, XLogP of 3.74, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-5-thiophen-2-ylphenol is sourced from PubChem (CID 173292102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).