boranuide;tributyl(cyclohexyl)phosphanium

C18H42BP — CID 173280265

IUPACboranuide;tributyl(cyclohexyl)phosphanium
SMILESCCCC[P+](CCCC)(CCCC)C1CCCCC1.[BH4-]
InChIInChI=1S/C18H38P.BH4/c1-4-7-15-19(16-8-5-2,17-9-6-3)18-13-11-10-12-14-18;/h18H,4-17H2,1-3H3;1H4/q+1;-1
InChIKeyBSUSXEUDEQKHFV-UHFFFAOYSA-N
MW300.32 g/mol
LogP5.29
Rot. Bonds10

About boranuide;tributyl(cyclohexyl)phosphanium

boranuide;tributyl(cyclohexyl)phosphanium (PubChem CID 173280265) has the molecular formula C18H42BP and a molecular weight of 300.32 g/mol. Its IUPAC name is boranuide;tributyl(cyclohexyl)phosphanium.

Molecular Properties

Compound Nameboranuide;tributyl(cyclohexyl)phosphanium
PubChem CID173280265
Molecular FormulaC18H42BP
Molecular Weight300.32 g/mol
Exact Mass300.31
IUPAC Nameboranuide;tributyl(cyclohexyl)phosphanium
SMILESCCCC[P+](CCCC)(CCCC)C1CCCCC1.[BH4-]
InChIInChI=1S/C18H38P.BH4/c1-4-7-15-19(16-8-5-2,17-9-6-3)18-13-11-10-12-14-18;/h18H,4-17H2,1-3H3;1H4/q+1;-1
InChIKeyBSUSXEUDEQKHFV-UHFFFAOYSA-N
XLogP5.29
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds10
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500300.32
LogP ≤ 55.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

tributyl(cyclohexyl)phosphanium acetate
CID 18355957
1-cyclopropylpentylcycloheptane
CID 91177068
[(E)-oct-2-en-4-yl]cyclohexane
CID 134979965
CID 166445594
CID 166445594
undecan-5-ylcyclohexane
CID 524419
tributyl(cyclohexyloxy)phosphanium
CID 23415292
ethane;methylcyclohexane;2-methylhexane
CID 142043372
(1,1-dicyclohexyl-2-methylhexyl)cyclohexane
CID 141441140
(1R)-1-cyclopentylpentan-1-amine
CID 55292231
1-cyclohexyl-2-methyl-N-propylhexan-1-amine
CID 114246260
1-cyclohexylheptylcyclohexane
CID 16404
1-cycloheptyldecylcycloheptane
CID 20559033

Frequently Asked Questions

What is the IUPAC name of boranuide;tributyl(cyclohexyl)phosphanium?
The IUPAC name of boranuide;tributyl(cyclohexyl)phosphanium (CID 173280265) is boranuide;tributyl(cyclohexyl)phosphanium.
What is the SMILES notation for boranuide;tributyl(cyclohexyl)phosphanium?
The canonical SMILES for boranuide;tributyl(cyclohexyl)phosphanium is CCCC[P+](CCCC)(CCCC)C1CCCCC1.[BH4-].
What is the InChIKey of boranuide;tributyl(cyclohexyl)phosphanium?
The InChIKey is BSUSXEUDEQKHFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H38P.BH4/c1-4-7-15-19(16-8-5-2,17-9-6-3)18-13-11-10-12-14-18;/h18H,4-17H2,1-3H3;1H4/q+1;-1.
What are the key properties of boranuide;tributyl(cyclohexyl)phosphanium?
boranuide;tributyl(cyclohexyl)phosphanium has a molecular weight of 300.32 g/mol, XLogP of 5.29, 10 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for boranuide;tributyl(cyclohexyl)phosphanium is sourced from PubChem (CID 173280265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).