3-diphenylphosphanylprop-1-en-2-ol

C15H15OP — CID 58420868

IUPAC3-diphenylphosphanylprop-1-en-2-ol
SMILESC=C(O)CP(c1ccccc1)c1ccccc1
InChIInChI=1S/C15H15OP/c1-13(16)12-17(14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-11,16H,1,12H2
InChIKeyZPAJAACMVWXPRG-UHFFFAOYSA-N
MW242.26 g/mol
LogP3.19
Rot. Bonds4

About 3-diphenylphosphanylprop-1-en-2-ol

3-diphenylphosphanylprop-1-en-2-ol (PubChem CID 58420868) has the molecular formula C15H15OP and a molecular weight of 242.26 g/mol. Its IUPAC name is 3-diphenylphosphanylprop-1-en-2-ol.

Molecular Properties

Compound Name3-diphenylphosphanylprop-1-en-2-ol
PubChem CID58420868
Molecular FormulaC15H15OP
Molecular Weight242.26 g/mol
Exact Mass242.09
IUPAC Name3-diphenylphosphanylprop-1-en-2-ol
SMILESC=C(O)CP(c1ccccc1)c1ccccc1
InChIInChI=1S/C15H15OP/c1-13(16)12-17(14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-11,16H,1,12H2
InChIKeyZPAJAACMVWXPRG-UHFFFAOYSA-N
XLogP3.19
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.26
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-diphenylphosphanylprop-1-en-2-ol?
The IUPAC name of 3-diphenylphosphanylprop-1-en-2-ol (CID 58420868) is 3-diphenylphosphanylprop-1-en-2-ol.
What is the SMILES notation for 3-diphenylphosphanylprop-1-en-2-ol?
The canonical SMILES for 3-diphenylphosphanylprop-1-en-2-ol is C=C(O)CP(c1ccccc1)c1ccccc1.
What is the InChIKey of 3-diphenylphosphanylprop-1-en-2-ol?
The InChIKey is ZPAJAACMVWXPRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15OP/c1-13(16)12-17(14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-11,16H,1,12H2.
What are the key properties of 3-diphenylphosphanylprop-1-en-2-ol?
3-diphenylphosphanylprop-1-en-2-ol has a molecular weight of 242.26 g/mol, XLogP of 3.19, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-diphenylphosphanylprop-1-en-2-ol is sourced from PubChem (CID 58420868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).