(4-ethylphenyl)-bis(4-methoxyphenyl)-methylphosphanium

C23H26O2P+ — CID 123234194

IUPAC(4-ethylphenyl)-bis(4-methoxyphenyl)-methylphosphanium
SMILESCCc1ccc([P+](C)(c2ccc(OC)cc2)c2ccc(OC)cc2)cc1
InChIInChI=1S/C23H26O2P/c1-5-18-6-12-21(13-7-18)26(4,22-14-8-19(24-2)9-15-22)23-16-10-20(25-3)11-17-23/h6-17H,5H2,1-4H3/q+1
InChIKeyXKVHOFOUSIUOJN-UHFFFAOYSA-N
MW365.43 g/mol
LogP4.19
Rot. Bonds6

About (4-ethylphenyl)-bis(4-methoxyphenyl)-methylphosphanium

(4-ethylphenyl)-bis(4-methoxyphenyl)-methylphosphanium (PubChem CID 123234194) has the molecular formula C23H26O2P+ and a molecular weight of 365.43 g/mol. Its IUPAC name is (4-ethylphenyl)-bis(4-methoxyphenyl)-methylphosphanium.

Molecular Properties

Compound Name(4-ethylphenyl)-bis(4-methoxyphenyl)-methylphosphanium
PubChem CID123234194
Molecular FormulaC23H26O2P+
Molecular Weight365.43 g/mol
Exact Mass365.17
IUPAC Name(4-ethylphenyl)-bis(4-methoxyphenyl)-methylphosphanium
SMILESCCc1ccc([P+](C)(c2ccc(OC)cc2)c2ccc(OC)cc2)cc1
InChIInChI=1S/C23H26O2P/c1-5-18-6-12-21(13-7-18)26(4,22-14-8-19(24-2)9-15-22)23-16-10-20(25-3)11-17-23/h6-17H,5H2,1-4H3/q+1
InChIKeyXKVHOFOUSIUOJN-UHFFFAOYSA-N
XLogP4.19
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.43
LogP ≤ 54.19
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

1-ethyl-4-methylbenzene;methane;1-methoxy-4-methylbenzene;1,4-xylene
CID 157430816
1-ethyl-4-[(E)-2-(4-methoxyphenyl)ethenyl]benzene
CID 21449166
1-ethyl-4-methoxybenzene;5-ethyl-2-methoxypyrimidine;1-methoxy-4-methylbenzene
CID 145386274
1-(4-methoxyphenyl)propane-2-thiol
CID 63272833
N-[(4-ethylphenyl)-(4-methoxyphenyl)methyl]ethanamine
CID 43489197
anisole;ethane;4-ethylphenol;2-methylpropane
CID 169174728
ethanamine;1-ethyl-4-[(E)-2-(4-methoxyphenyl)ethenyl]benzene
CID 159851450
1-(4-ethylphenyl)-3-(4-methoxyphenyl)propan-1-ol
CID 61089071
1-(4-ethylphenyl)-4-(4-methoxyphenyl)butan-2-amine
CID 115803356
N-[(4-methoxyphenyl)methyl]-2-methylbutan-1-amine
CID 43201033
[4-(4-methoxybenzoyl)oxyphenyl] 4-ethylbenzoate
CID 118103231
ethane;formaldehyde;1-methoxy-4-[(2S)-2-methylbutyl]benzene
CID 171097729

Frequently Asked Questions

What is the IUPAC name of (4-ethylphenyl)-bis(4-methoxyphenyl)-methylphosphanium?
The IUPAC name of (4-ethylphenyl)-bis(4-methoxyphenyl)-methylphosphanium (CID 123234194) is (4-ethylphenyl)-bis(4-methoxyphenyl)-methylphosphanium.
What is the SMILES notation for (4-ethylphenyl)-bis(4-methoxyphenyl)-methylphosphanium?
The canonical SMILES for (4-ethylphenyl)-bis(4-methoxyphenyl)-methylphosphanium is CCc1ccc([P+](C)(c2ccc(OC)cc2)c2ccc(OC)cc2)cc1.
What is the InChIKey of (4-ethylphenyl)-bis(4-methoxyphenyl)-methylphosphanium?
The InChIKey is XKVHOFOUSIUOJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26O2P/c1-5-18-6-12-21(13-7-18)26(4,22-14-8-19(24-2)9-15-22)23-16-10-20(25-3)11-17-23/h6-17H,5H2,1-4H3/q+1.
What are the key properties of (4-ethylphenyl)-bis(4-methoxyphenyl)-methylphosphanium?
(4-ethylphenyl)-bis(4-methoxyphenyl)-methylphosphanium has a molecular weight of 365.43 g/mol, XLogP of 4.19, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethylphenyl)-bis(4-methoxyphenyl)-methylphosphanium is sourced from PubChem (CID 123234194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).