dimethoxy-(4-prop-2-enylphenyl)phosphane

C11H15O2P — CID 153377611

IUPACdimethoxy-(4-prop-2-enylphenyl)phosphane
SMILESC=CCc1ccc(P(OC)OC)cc1
InChIInChI=1S/C11H15O2P/c1-4-5-10-6-8-11(9-7-10)14(12-2)13-3/h4,6-9H,1,5H2,2-3H3
InChIKeyHASSSALYHKJHEW-UHFFFAOYSA-N
MW210.21 g/mol
LogP2.65
Rot. Bonds5

About dimethoxy-(4-prop-2-enylphenyl)phosphane

dimethoxy-(4-prop-2-enylphenyl)phosphane (PubChem CID 153377611) has the molecular formula C11H15O2P and a molecular weight of 210.21 g/mol. Its IUPAC name is dimethoxy-(4-prop-2-enylphenyl)phosphane.

Molecular Properties

Compound Namedimethoxy-(4-prop-2-enylphenyl)phosphane
PubChem CID153377611
Molecular FormulaC11H15O2P
Molecular Weight210.21 g/mol
Exact Mass210.08
IUPAC Namedimethoxy-(4-prop-2-enylphenyl)phosphane
SMILESC=CCc1ccc(P(OC)OC)cc1
InChIInChI=1S/C11H15O2P/c1-4-5-10-6-8-11(9-7-10)14(12-2)13-3/h4,6-9H,1,5H2,2-3H3
InChIKeyHASSSALYHKJHEW-UHFFFAOYSA-N
XLogP2.65
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.21
LogP ≤ 52.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze dimethoxy-(4-prop-2-enylphenyl)phosphane 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 dimethoxy-(4-prop-2-enylphenyl)phosphane?
The IUPAC name of dimethoxy-(4-prop-2-enylphenyl)phosphane (CID 153377611) is dimethoxy-(4-prop-2-enylphenyl)phosphane.
What is the SMILES notation for dimethoxy-(4-prop-2-enylphenyl)phosphane?
The canonical SMILES for dimethoxy-(4-prop-2-enylphenyl)phosphane is C=CCc1ccc(P(OC)OC)cc1.
What is the InChIKey of dimethoxy-(4-prop-2-enylphenyl)phosphane?
The InChIKey is HASSSALYHKJHEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15O2P/c1-4-5-10-6-8-11(9-7-10)14(12-2)13-3/h4,6-9H,1,5H2,2-3H3.
What are the key properties of dimethoxy-(4-prop-2-enylphenyl)phosphane?
dimethoxy-(4-prop-2-enylphenyl)phosphane has a molecular weight of 210.21 g/mol, XLogP of 2.65, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dimethoxy-(4-prop-2-enylphenyl)phosphane is sourced from PubChem (CID 153377611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).