triethyl(trityl)phosphanium

C25H30P+ — CID 18355930

IUPACtriethyl(trityl)phosphanium
SMILESCC[P+](CC)(CC)C(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H30P/c1-4-26(5-2,6-3)25(22-16-10-7-11-17-22,23-18-12-8-13-19-23)24-20-14-9-15-21-24/h7-21H,4-6H2,1-3H3/q+1
InChIKeyWTRCPLPHYRHBJA-UHFFFAOYSA-N
MW361.49 g/mol
LogP7.06
Rot. Bonds7

About triethyl(trityl)phosphanium

triethyl(trityl)phosphanium (PubChem CID 18355930) has the molecular formula C25H30P+ and a molecular weight of 361.49 g/mol. Its IUPAC name is triethyl(trityl)phosphanium.

Molecular Properties

Compound Nametriethyl(trityl)phosphanium
PubChem CID18355930
Molecular FormulaC25H30P+
Molecular Weight361.49 g/mol
Exact Mass361.21
IUPAC Nametriethyl(trityl)phosphanium
SMILESCC[P+](CC)(CC)C(c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H30P/c1-4-26(5-2,6-3)25(22-16-10-7-11-17-22,23-18-12-8-13-19-23)24-20-14-9-15-21-24/h7-21H,4-6H2,1-3H3/q+1
InChIKeyWTRCPLPHYRHBJA-UHFFFAOYSA-N
XLogP7.06
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500361.49
LogP ≤ 57.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

tributyl(trityl)phosphanium fluoride
CID 18356165
trimethyl(trityl)phosphanium fluoride
CID 18356035
propanoate;trimethyl(trityl)phosphanium
CID 18355979
tert-butylbenzene;3-ethyl-2-methylpentane
CID 177346689
CID 142554279
CID 142554279
2,3-dimethylbutan-2-ylbenzene;ethane;2-methylbutane
CID 142581096
(3,4-dimethyl-2-phenylhexan-2-yl)benzene
CID 154351099
3-methyl-2-phenylpentan-2-ol
CID 13024634
2-ethyl-3-hydroxy-3-phenylbutanenitrile
CID 79129309
1-tritylsulfanylpropan-1-ol
CID 141363719
3-ethyl-2-methyl-2-phenylpentanoic acid
CID 158698282
1,1,2-triphenylbutylphosphane
CID 19027387

Frequently Asked Questions

What is the IUPAC name of triethyl(trityl)phosphanium?
The IUPAC name of triethyl(trityl)phosphanium (CID 18355930) is triethyl(trityl)phosphanium.
What is the SMILES notation for triethyl(trityl)phosphanium?
The canonical SMILES for triethyl(trityl)phosphanium is CC[P+](CC)(CC)C(c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of triethyl(trityl)phosphanium?
The InChIKey is WTRCPLPHYRHBJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H30P/c1-4-26(5-2,6-3)25(22-16-10-7-11-17-22,23-18-12-8-13-19-23)24-20-14-9-15-21-24/h7-21H,4-6H2,1-3H3/q+1.
What are the key properties of triethyl(trityl)phosphanium?
triethyl(trityl)phosphanium has a molecular weight of 361.49 g/mol, XLogP of 7.06, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl(trityl)phosphanium is sourced from PubChem (CID 18355930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).