methyl-diphenyl-propan-2-ylphosphanium

C16H20P+ — CID 23412999

IUPACmethyl-diphenyl-propan-2-ylphosphanium
SMILESCC(C)[P+](C)(c1ccccc1)c1ccccc1
InChIInChI=1S/C16H20P/c1-14(2)17(3,15-10-6-4-7-11-15)16-12-8-5-9-13-16/h4-14H,1-3H3/q+1
InChIKeySLNYZODTXJMHEY-UHFFFAOYSA-N
MW243.31 g/mol
LogP3.69
Rot. Bonds3

About methyl-diphenyl-propan-2-ylphosphanium

methyl-diphenyl-propan-2-ylphosphanium (PubChem CID 23412999) has the molecular formula C16H20P+ and a molecular weight of 243.31 g/mol. Its IUPAC name is methyl-diphenyl-propan-2-ylphosphanium.

Molecular Properties

Compound Namemethyl-diphenyl-propan-2-ylphosphanium
PubChem CID23412999
Molecular FormulaC16H20P+
Molecular Weight243.31 g/mol
Exact Mass243.13
IUPAC Namemethyl-diphenyl-propan-2-ylphosphanium
SMILESCC(C)[P+](C)(c1ccccc1)c1ccccc1
InChIInChI=1S/C16H20P/c1-14(2)17(3,15-10-6-4-7-11-15)16-12-8-5-9-13-16/h4-14H,1-3H3/q+1
InChIKeySLNYZODTXJMHEY-UHFFFAOYSA-N
XLogP3.69
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of methyl-diphenyl-propan-2-ylphosphanium?
The IUPAC name of methyl-diphenyl-propan-2-ylphosphanium (CID 23412999) is methyl-diphenyl-propan-2-ylphosphanium.
What is the SMILES notation for methyl-diphenyl-propan-2-ylphosphanium?
The canonical SMILES for methyl-diphenyl-propan-2-ylphosphanium is CC(C)[P+](C)(c1ccccc1)c1ccccc1.
What is the InChIKey of methyl-diphenyl-propan-2-ylphosphanium?
The InChIKey is SLNYZODTXJMHEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20P/c1-14(2)17(3,15-10-6-4-7-11-15)16-12-8-5-9-13-16/h4-14H,1-3H3/q+1.
What are the key properties of methyl-diphenyl-propan-2-ylphosphanium?
methyl-diphenyl-propan-2-ylphosphanium has a molecular weight of 243.31 g/mol, XLogP of 3.69, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-diphenyl-propan-2-ylphosphanium is sourced from PubChem (CID 23412999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).