3-ethenylphenol

C8H8O — CID 3013921

IUPAC3-ethenylphenol
SMILESC=Cc1cccc(O)c1
InChIInChI=1S/C8H8O/c1-2-7-4-3-5-8(9)6-7/h2-6,9H,1H2
InChIKeyYNGIFMKMDRDNBQ-UHFFFAOYSA-N
MW120.15 g/mol
LogP2.04
Rot. Bonds1

About 3-ethenylphenol

3-ethenylphenol (PubChem CID 3013921) has the molecular formula C8H8O and a molecular weight of 120.15 g/mol. Its IUPAC name is 3-ethenylphenol.

Molecular Properties

Compound Name3-ethenylphenol
PubChem CID3013921
Molecular FormulaC8H8O
Molecular Weight120.15 g/mol
Exact Mass120.06
IUPAC Name3-ethenylphenol
SMILESC=Cc1cccc(O)c1
InChIInChI=1S/C8H8O/c1-2-7-4-3-5-8(9)6-7/h2-6,9H,1H2
InChIKeyYNGIFMKMDRDNBQ-UHFFFAOYSA-N
XLogP2.04
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.15
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-ethenylphenol?
The IUPAC name of 3-ethenylphenol (CID 3013921) is 3-ethenylphenol.
What is the SMILES notation for 3-ethenylphenol?
The canonical SMILES for 3-ethenylphenol is C=Cc1cccc(O)c1.
What is the InChIKey of 3-ethenylphenol?
The InChIKey is YNGIFMKMDRDNBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8O/c1-2-7-4-3-5-8(9)6-7/h2-6,9H,1H2.
What are the key properties of 3-ethenylphenol?
3-ethenylphenol has a molecular weight of 120.15 g/mol, XLogP of 2.04, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethenylphenol is sourced from PubChem (CID 3013921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).