2-methylphenol;thiophene

C11H12OS — CID 158862587

IUPAC2-methylphenol;thiophene
SMILESCc1ccccc1O.c1ccsc1
InChIInChI=1S/C7H8O.C4H4S/c1-6-4-2-3-5-7(6)8;1-2-4-5-3-1/h2-5,8H,1H3;1-4H
InChIKeyJAVGSMPWTMOXBR-UHFFFAOYSA-N
MW192.28 g/mol
LogP3.45
Rot. Bonds

About 2-methylphenol;thiophene

2-methylphenol;thiophene (PubChem CID 158862587) has the molecular formula C11H12OS and a molecular weight of 192.28 g/mol. Its IUPAC name is 2-methylphenol;thiophene.

Molecular Properties

Compound Name2-methylphenol;thiophene
PubChem CID158862587
Molecular FormulaC11H12OS
Molecular Weight192.28 g/mol
Exact Mass192.06
IUPAC Name2-methylphenol;thiophene
SMILESCc1ccccc1O.c1ccsc1
InChIInChI=1S/C7H8O.C4H4S/c1-6-4-2-3-5-7(6)8;1-2-4-5-3-1/h2-5,8H,1H3;1-4H
InChIKeyJAVGSMPWTMOXBR-UHFFFAOYSA-N
XLogP3.45
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.28
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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2-methylphenol;bis(4-methylphenol)
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hydroperoxymethane;2-methylphenol
CID 87131667
1,2-dichlorobenzene;2-methylphenol
CID 159780398
2,3-dimethylphenol;bis(2-methylphenol)
CID 67655814
ethanol;bis(2-methylphenol);titanium
CID 22238726
bis(2,6-dimethylphenol);2-methylphenol;phenol
CID 67931850
bicyclo[2.2.0]hexane;2-methylphenol
CID 70270584

Frequently Asked Questions

What is the IUPAC name of 2-methylphenol;thiophene?
The IUPAC name of 2-methylphenol;thiophene (CID 158862587) is 2-methylphenol;thiophene.
What is the SMILES notation for 2-methylphenol;thiophene?
The canonical SMILES for 2-methylphenol;thiophene is Cc1ccccc1O.c1ccsc1.
What is the InChIKey of 2-methylphenol;thiophene?
The InChIKey is JAVGSMPWTMOXBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8O.C4H4S/c1-6-4-2-3-5-7(6)8;1-2-4-5-3-1/h2-5,8H,1H3;1-4H.
What are the key properties of 2-methylphenol;thiophene?
2-methylphenol;thiophene has a molecular weight of 192.28 g/mol, XLogP of 3.45, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylphenol;thiophene is sourced from PubChem (CID 158862587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).