2,6-bis(prop-2-enyl)-4-propylphenol

C15H20O — CID 67656083

IUPAC2,6-bis(prop-2-enyl)-4-propylphenol
SMILESC=CCc1cc(CCC)cc(CC=C)c1O
InChIInChI=1S/C15H20O/c1-4-7-12-10-13(8-5-2)15(16)14(11-12)9-6-3/h5-6,10-11,16H,2-4,7-9H2,1H3
InChIKeyJFVDQOOTBHSRPW-UHFFFAOYSA-N
MW216.32 g/mol
LogP3.80
Rot. Bonds6

About 2,6-bis(prop-2-enyl)-4-propylphenol

2,6-bis(prop-2-enyl)-4-propylphenol (PubChem CID 67656083) has the molecular formula C15H20O and a molecular weight of 216.32 g/mol. Its IUPAC name is 2,6-bis(prop-2-enyl)-4-propylphenol.

Molecular Properties

Compound Name2,6-bis(prop-2-enyl)-4-propylphenol
PubChem CID67656083
Molecular FormulaC15H20O
Molecular Weight216.32 g/mol
Exact Mass216.15
IUPAC Name2,6-bis(prop-2-enyl)-4-propylphenol
SMILESC=CCc1cc(CCC)cc(CC=C)c1O
InChIInChI=1S/C15H20O/c1-4-7-12-10-13(8-5-2)15(16)14(11-12)9-6-3/h5-6,10-11,16H,2-4,7-9H2,1H3
InChIKeyJFVDQOOTBHSRPW-UHFFFAOYSA-N
XLogP3.80
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 2,6-bis(prop-2-enyl)-4-propylphenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,6-bis(prop-2-enyl)-4-propylphenol?
The IUPAC name of 2,6-bis(prop-2-enyl)-4-propylphenol (CID 67656083) is 2,6-bis(prop-2-enyl)-4-propylphenol.
What is the SMILES notation for 2,6-bis(prop-2-enyl)-4-propylphenol?
The canonical SMILES for 2,6-bis(prop-2-enyl)-4-propylphenol is C=CCc1cc(CCC)cc(CC=C)c1O.
What is the InChIKey of 2,6-bis(prop-2-enyl)-4-propylphenol?
The InChIKey is JFVDQOOTBHSRPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20O/c1-4-7-12-10-13(8-5-2)15(16)14(11-12)9-6-3/h5-6,10-11,16H,2-4,7-9H2,1H3.
What are the key properties of 2,6-bis(prop-2-enyl)-4-propylphenol?
2,6-bis(prop-2-enyl)-4-propylphenol has a molecular weight of 216.32 g/mol, XLogP of 3.80, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-bis(prop-2-enyl)-4-propylphenol is sourced from PubChem (CID 67656083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).