2-(2-methoxyphenyl)ethyl-oxo-phenylphosphanium

C15H16O2P+ — CID 69220036

IUPAC2-(2-methoxyphenyl)ethyl-oxo-phenylphosphanium
SMILESCOc1ccccc1CC[P+](=O)c1ccccc1
InChIInChI=1S/C15H16O2P/c1-17-15-10-6-5-7-13(15)11-12-18(16)14-8-3-2-4-9-14/h2-10H,11-12H2,1H3/q+1
InChIKeyOWPJOOOPBPVCCU-UHFFFAOYSA-N
MW259.27 g/mol
LogP3.39
Rot. Bonds5

About 2-(2-methoxyphenyl)ethyl-oxo-phenylphosphanium

2-(2-methoxyphenyl)ethyl-oxo-phenylphosphanium (PubChem CID 69220036) has the molecular formula C15H16O2P+ and a molecular weight of 259.27 g/mol. Its IUPAC name is 2-(2-methoxyphenyl)ethyl-oxo-phenylphosphanium.

Molecular Properties

Compound Name2-(2-methoxyphenyl)ethyl-oxo-phenylphosphanium
PubChem CID69220036
Molecular FormulaC15H16O2P+
Molecular Weight259.27 g/mol
Exact Mass259.09
IUPAC Name2-(2-methoxyphenyl)ethyl-oxo-phenylphosphanium
SMILESCOc1ccccc1CC[P+](=O)c1ccccc1
InChIInChI=1S/C15H16O2P/c1-17-15-10-6-5-7-13(15)11-12-18(16)14-8-3-2-4-9-14/h2-10H,11-12H2,1H3/q+1
InChIKeyOWPJOOOPBPVCCU-UHFFFAOYSA-N
XLogP3.39
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.27
LogP ≤ 53.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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2-[2-(2-methoxyphenyl)ethyl]phenol
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5-(2-methoxyphenyl)pentanoic acid
CID 25050817
acetylene;1-(2-bromoethyl)-2-methoxybenzene
CID 143927772
1-(3,3-dimethylbutyl)-2-methoxybenzene
CID 15437580
7-(2-methoxyphenyl)heptanoic acid
CID 59451681
CID 88740626
CID 88740626
1-methoxy-2-(2-phenylsulfanylethyl)benzene
CID 101404831
2-[2-(2-methoxyphenyl)ethylsulfanyl]acetic acid
CID 94768509

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenyl)ethyl-oxo-phenylphosphanium?
The IUPAC name of 2-(2-methoxyphenyl)ethyl-oxo-phenylphosphanium (CID 69220036) is 2-(2-methoxyphenyl)ethyl-oxo-phenylphosphanium.
What is the SMILES notation for 2-(2-methoxyphenyl)ethyl-oxo-phenylphosphanium?
The canonical SMILES for 2-(2-methoxyphenyl)ethyl-oxo-phenylphosphanium is COc1ccccc1CC[P+](=O)c1ccccc1.
What is the InChIKey of 2-(2-methoxyphenyl)ethyl-oxo-phenylphosphanium?
The InChIKey is OWPJOOOPBPVCCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16O2P/c1-17-15-10-6-5-7-13(15)11-12-18(16)14-8-3-2-4-9-14/h2-10H,11-12H2,1H3/q+1.
What are the key properties of 2-(2-methoxyphenyl)ethyl-oxo-phenylphosphanium?
2-(2-methoxyphenyl)ethyl-oxo-phenylphosphanium has a molecular weight of 259.27 g/mol, XLogP of 3.39, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenyl)ethyl-oxo-phenylphosphanium is sourced from PubChem (CID 69220036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).