3-ethenylphenol;methanol;4-methylphenol

C16H20O3 — CID 144866816

IUPAC3-ethenylphenol;methanol;4-methylphenol
SMILESC=Cc1cccc(O)c1.CO.Cc1ccc(O)cc1
InChIInChI=1S/C8H8O.C7H8O.CH4O/c1-2-7-4-3-5-8(9)6-7;1-6-2-4-7(8)5-3-6;1-2/h2-6,9H,1H2;2-5,8H,1H3;2H,1H3
InChIKeyUOSIHMQBDCLFDX-UHFFFAOYSA-N
MW260.33 g/mol
LogP3.34
Rot. Bonds1

About 3-ethenylphenol;methanol;4-methylphenol

3-ethenylphenol;methanol;4-methylphenol (PubChem CID 144866816) has the molecular formula C16H20O3 and a molecular weight of 260.33 g/mol. Its IUPAC name is 3-ethenylphenol;methanol;4-methylphenol.

Molecular Properties

Compound Name3-ethenylphenol;methanol;4-methylphenol
PubChem CID144866816
Molecular FormulaC16H20O3
Molecular Weight260.33 g/mol
Exact Mass260.14
IUPAC Name3-ethenylphenol;methanol;4-methylphenol
SMILESC=Cc1cccc(O)c1.CO.Cc1ccc(O)cc1
InChIInChI=1S/C8H8O.C7H8O.CH4O/c1-2-7-4-3-5-8(9)6-7;1-6-2-4-7(8)5-3-6;1-2/h2-6,9H,1H2;2-5,8H,1H3;2H,1H3
InChIKeyUOSIHMQBDCLFDX-UHFFFAOYSA-N
XLogP3.34
TPSA60.69 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.33
LogP ≤ 53.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

bis(cyclopenta-1,3-diene);bis(3-ethenylphenol);zirconium(2+)
CID 141004855
1-ethenyl-3-methylbenzene
CID 7529
3-[(Z)-2-(3-hydroxyphenyl)ethenyl]phenol;3-[(E)-2-(3-methylphenyl)ethenyl]phenol
CID 159541553
3-methylphenol;4-methylphenol;propane
CID 157147188
phenol;styrene
CID 160675765
4-methylphenol
CID 70549076
3-[(E)-2-[4-(4-methylanilino)phenyl]ethenyl]phenol
CID 67605326
1-[bis(4-methylphenyl)methyl]-3-ethenylbenzene
CID 58982919
benzene;ethene;phenol;styrene
CID 174599559
1-ethenyl-4-methylbenzene;styrene
CID 159659441
3-ethenyl-4-[2-(3-hydroxyphenyl)ethenyl]phenol
CID 174056763
N,4-dimethylaniline;1-ethenyl-3-methylbenzene
CID 142013646

Frequently Asked Questions

What is the IUPAC name of 3-ethenylphenol;methanol;4-methylphenol?
The IUPAC name of 3-ethenylphenol;methanol;4-methylphenol (CID 144866816) is 3-ethenylphenol;methanol;4-methylphenol.
What is the SMILES notation for 3-ethenylphenol;methanol;4-methylphenol?
The canonical SMILES for 3-ethenylphenol;methanol;4-methylphenol is C=Cc1cccc(O)c1.CO.Cc1ccc(O)cc1.
What is the InChIKey of 3-ethenylphenol;methanol;4-methylphenol?
The InChIKey is UOSIHMQBDCLFDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8O.C7H8O.CH4O/c1-2-7-4-3-5-8(9)6-7;1-6-2-4-7(8)5-3-6;1-2/h2-6,9H,1H2;2-5,8H,1H3;2H,1H3.
What are the key properties of 3-ethenylphenol;methanol;4-methylphenol?
3-ethenylphenol;methanol;4-methylphenol has a molecular weight of 260.33 g/mol, XLogP of 3.34, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethenylphenol;methanol;4-methylphenol is sourced from PubChem (CID 144866816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).