bismuthane;trioctylphosphane

C24H54BiP — CID 174398286

IUPACbismuthane;trioctylphosphane
SMILESCCCCCCCCP(CCCCCCCC)CCCCCCCC.[BiH3]
InChIInChI=1S/C24H51P.Bi.3H/c1-4-7-10-13-16-19-22-25(23-20-17-14-11-8-5-2)24-21-18-15-12-9-6-3;;;;/h4-24H2,1-3H3;;;;
InChIKeyFKQJAXFBMJZRNL-UHFFFAOYSA-N
MW582.65 g/mol
LogP8.37
Rot. Bonds21

About bismuthane;trioctylphosphane

bismuthane;trioctylphosphane (PubChem CID 174398286) has the molecular formula C24H54BiP and a molecular weight of 582.65 g/mol. Its IUPAC name is bismuthane;trioctylphosphane.

Molecular Properties

Compound Namebismuthane;trioctylphosphane
PubChem CID174398286
Molecular FormulaC24H54BiP
Molecular Weight582.65 g/mol
Exact Mass582.38
IUPAC Namebismuthane;trioctylphosphane
SMILESCCCCCCCCP(CCCCCCCC)CCCCCCCC.[BiH3]
InChIInChI=1S/C24H51P.Bi.3H/c1-4-7-10-13-16-19-22-25(23-20-17-14-11-8-5-2)24-21-18-15-12-9-6-3;;;;/h4-24H2,1-3H3;;;;
InChIKeyFKQJAXFBMJZRNL-UHFFFAOYSA-N
XLogP8.37
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds21
Heavy Atoms26
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500582.65
LogP ≤ 58.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

4-dihexylphosphanylbutyl(dihexyl)phosphane
CID 90109945
hexyl-octyl-pentylphosphane
CID 90108526
dodecane;trioctylphosphane;dihydrobromide
CID 173344161
2-diheptylphosphanylethyl(diheptyl)phosphane
CID 90110075
dibutyl(decyl)phosphane
CID 171559269
tris(trioctylphosphane);tungsten
CID 158972203
2-dioctadecylphosphanylethyl(dioctadecyl)phosphane
CID 21448799
dibutyl(tetradecyl)phosphane
CID 118319275
tripentylphosphane
CID 2784073
cadmium;selane;trioctylphosphane
CID 174961482
bromomethane;trioctylphosphane
CID 175266178
azane;trioctylphosphane;hydrobromide
CID 174675093

Frequently Asked Questions

What is the IUPAC name of bismuthane;trioctylphosphane?
The IUPAC name of bismuthane;trioctylphosphane (CID 174398286) is bismuthane;trioctylphosphane.
What is the SMILES notation for bismuthane;trioctylphosphane?
The canonical SMILES for bismuthane;trioctylphosphane is CCCCCCCCP(CCCCCCCC)CCCCCCCC.[BiH3].
What is the InChIKey of bismuthane;trioctylphosphane?
The InChIKey is FKQJAXFBMJZRNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H51P.Bi.3H/c1-4-7-10-13-16-19-22-25(23-20-17-14-11-8-5-2)24-21-18-15-12-9-6-3;;;;/h4-24H2,1-3H3;;;;.
What are the key properties of bismuthane;trioctylphosphane?
bismuthane;trioctylphosphane has a molecular weight of 582.65 g/mol, XLogP of 8.37, 21 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bismuthane;trioctylphosphane is sourced from PubChem (CID 174398286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).