3-methyl-5-prop-1-enylphenol

C10H12O — CID 150421190

IUPAC3-methyl-5-prop-1-enylphenol
SMILESCC=Cc1cc(C)cc(O)c1
InChIInChI=1S/C10H12O/c1-3-4-9-5-8(2)6-10(11)7-9/h3-7,11H,1-2H3
InChIKeyHHUWNGLYYHBNKD-UHFFFAOYSA-N
MW148.20 g/mol
LogP2.73
Rot. Bonds1

About 3-methyl-5-prop-1-enylphenol

3-methyl-5-prop-1-enylphenol (PubChem CID 150421190) has the molecular formula C10H12O and a molecular weight of 148.20 g/mol. Its IUPAC name is 3-methyl-5-prop-1-enylphenol.

Molecular Properties

Compound Name3-methyl-5-prop-1-enylphenol
PubChem CID150421190
Molecular FormulaC10H12O
Molecular Weight148.20 g/mol
Exact Mass148.09
IUPAC Name3-methyl-5-prop-1-enylphenol
SMILESCC=Cc1cc(C)cc(O)c1
InChIInChI=1S/C10H12O/c1-3-4-9-5-8(2)6-10(11)7-9/h3-7,11H,1-2H3
InChIKeyHHUWNGLYYHBNKD-UHFFFAOYSA-N
XLogP2.73
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.20
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-prop-1-enylphenol?
The IUPAC name of 3-methyl-5-prop-1-enylphenol (CID 150421190) is 3-methyl-5-prop-1-enylphenol.
What is the SMILES notation for 3-methyl-5-prop-1-enylphenol?
The canonical SMILES for 3-methyl-5-prop-1-enylphenol is CC=Cc1cc(C)cc(O)c1.
What is the InChIKey of 3-methyl-5-prop-1-enylphenol?
The InChIKey is HHUWNGLYYHBNKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12O/c1-3-4-9-5-8(2)6-10(11)7-9/h3-7,11H,1-2H3.
What are the key properties of 3-methyl-5-prop-1-enylphenol?
3-methyl-5-prop-1-enylphenol has a molecular weight of 148.20 g/mol, XLogP of 2.73, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-prop-1-enylphenol is sourced from PubChem (CID 150421190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).