3-ethenyl-2-methylphenol

C9H10O — CID 22336775

IUPAC3-ethenyl-2-methylphenol
SMILESC=Cc1cccc(O)c1C
InChIInChI=1S/C9H10O/c1-3-8-5-4-6-9(10)7(8)2/h3-6,10H,1H2,2H3
InChIKeyWOOIWZFSSZZIDE-UHFFFAOYSA-N
MW134.18 g/mol
LogP2.34
Rot. Bonds1

About 3-ethenyl-2-methylphenol

3-ethenyl-2-methylphenol (PubChem CID 22336775) has the molecular formula C9H10O and a molecular weight of 134.18 g/mol. Its IUPAC name is 3-ethenyl-2-methylphenol.

Molecular Properties

Compound Name3-ethenyl-2-methylphenol
PubChem CID22336775
Molecular FormulaC9H10O
Molecular Weight134.18 g/mol
Exact Mass134.07
IUPAC Name3-ethenyl-2-methylphenol
SMILESC=Cc1cccc(O)c1C
InChIInChI=1S/C9H10O/c1-3-8-5-4-6-9(10)7(8)2/h3-6,10H,1H2,2H3
InChIKeyWOOIWZFSSZZIDE-UHFFFAOYSA-N
XLogP2.34
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.18
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-ethenyl-2-methylphenol?
The IUPAC name of 3-ethenyl-2-methylphenol (CID 22336775) is 3-ethenyl-2-methylphenol.
What is the SMILES notation for 3-ethenyl-2-methylphenol?
The canonical SMILES for 3-ethenyl-2-methylphenol is C=Cc1cccc(O)c1C.
What is the InChIKey of 3-ethenyl-2-methylphenol?
The InChIKey is WOOIWZFSSZZIDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10O/c1-3-8-5-4-6-9(10)7(8)2/h3-6,10H,1H2,2H3.
What are the key properties of 3-ethenyl-2-methylphenol?
3-ethenyl-2-methylphenol has a molecular weight of 134.18 g/mol, XLogP of 2.34, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethenyl-2-methylphenol is sourced from PubChem (CID 22336775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).