trichloro(cyclohexyl)phosphanium

C6H11Cl3P+ — CID 23415122

IUPACtrichloro(cyclohexyl)phosphanium
SMILESCl[P+](Cl)(Cl)C1CCCCC1
InChIInChI=1S/C6H11Cl3P/c7-10(8,9)6-4-2-1-3-5-6/h6H,1-5H2/q+1
InChIKeyJSYHJJUCAWEHRE-UHFFFAOYSA-N
MW220.49 g/mol
LogP4.80
Rot. Bonds1

About trichloro(cyclohexyl)phosphanium

trichloro(cyclohexyl)phosphanium (PubChem CID 23415122) has the molecular formula C6H11Cl3P+ and a molecular weight of 220.49 g/mol. Its IUPAC name is trichloro(cyclohexyl)phosphanium.

Molecular Properties

Compound Nametrichloro(cyclohexyl)phosphanium
PubChem CID23415122
Molecular FormulaC6H11Cl3P+
Molecular Weight220.49 g/mol
Exact Mass218.97
IUPAC Nametrichloro(cyclohexyl)phosphanium
SMILESCl[P+](Cl)(Cl)C1CCCCC1
InChIInChI=1S/C6H11Cl3P/c7-10(8,9)6-4-2-1-3-5-6/h6H,1-5H2/q+1
InChIKeyJSYHJJUCAWEHRE-UHFFFAOYSA-N
XLogP4.80
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.49
LogP ≤ 54.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

cyclohexane;dichloromethylcyclohexane
CID 118430501
tricyclohexyl(methyl)phosphanium chloride
CID 19001088
CID 174647360
CID 174647360
1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene;chloroform
CID 159161926
(2S)-2-chloro-2-cyclohexylacetonitrile
CID 94056855
chloro-cyclohexyl-(dichloromethyl)phosphane
CID 13354579
1-chloroethylcyclododecane
CID 66468842
CID 136690039
CID 136690039
[chloro(fluoro)methyl]cyclohexane
CID 134937924
iodo(tricyclohexylphosphaniumyl)boranuide
CID 134904418
CID 174477587
CID 174477587
cyclohexyl(trimethyl)phosphanium;tetramethylphosphanium;bromide;hydroxide
CID 157358455

Frequently Asked Questions

What is the IUPAC name of trichloro(cyclohexyl)phosphanium?
The IUPAC name of trichloro(cyclohexyl)phosphanium (CID 23415122) is trichloro(cyclohexyl)phosphanium.
What is the SMILES notation for trichloro(cyclohexyl)phosphanium?
The canonical SMILES for trichloro(cyclohexyl)phosphanium is Cl[P+](Cl)(Cl)C1CCCCC1.
What is the InChIKey of trichloro(cyclohexyl)phosphanium?
The InChIKey is JSYHJJUCAWEHRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11Cl3P/c7-10(8,9)6-4-2-1-3-5-6/h6H,1-5H2/q+1.
What are the key properties of trichloro(cyclohexyl)phosphanium?
trichloro(cyclohexyl)phosphanium has a molecular weight of 220.49 g/mol, XLogP of 4.80, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trichloro(cyclohexyl)phosphanium is sourced from PubChem (CID 23415122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).