propoxysilane;trioctylphosphane

C27H61OPSi — CID 175291717

IUPACpropoxysilane;trioctylphosphane
SMILESCCCCCCCCP(CCCCCCCC)CCCCCCCC.CCCO[SiH3]
InChIInChI=1S/C24H51P.C3H10OSi/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;1-2-3-4-5/h4-24H2,1-3H3;2-3H2,1,5H3
InChIKeyCHFKGDPQYAMBOG-UHFFFAOYSA-N
MW460.84 g/mol
LogP9.24
Rot. Bonds23

About propoxysilane;trioctylphosphane

propoxysilane;trioctylphosphane (PubChem CID 175291717) has the molecular formula C27H61OPSi and a molecular weight of 460.84 g/mol. Its IUPAC name is propoxysilane;trioctylphosphane.

Molecular Properties

Compound Namepropoxysilane;trioctylphosphane
PubChem CID175291717
Molecular FormulaC27H61OPSi
Molecular Weight460.84 g/mol
Exact Mass460.42
IUPAC Namepropoxysilane;trioctylphosphane
SMILESCCCCCCCCP(CCCCCCCC)CCCCCCCC.CCCO[SiH3]
InChIInChI=1S/C24H51P.C3H10OSi/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;1-2-3-4-5/h4-24H2,1-3H3;2-3H2,1,5H3
InChIKeyCHFKGDPQYAMBOG-UHFFFAOYSA-N
XLogP9.24
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds23
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500460.84
LogP ≤ 59.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', '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
bismuthane;trioctylphosphane
CID 174398286
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

Frequently Asked Questions

What is the IUPAC name of propoxysilane;trioctylphosphane?
The IUPAC name of propoxysilane;trioctylphosphane (CID 175291717) is propoxysilane;trioctylphosphane.
What is the SMILES notation for propoxysilane;trioctylphosphane?
The canonical SMILES for propoxysilane;trioctylphosphane is CCCCCCCCP(CCCCCCCC)CCCCCCCC.CCCO[SiH3].
What is the InChIKey of propoxysilane;trioctylphosphane?
The InChIKey is CHFKGDPQYAMBOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H51P.C3H10OSi/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;1-2-3-4-5/h4-24H2,1-3H3;2-3H2,1,5H3.
What are the key properties of propoxysilane;trioctylphosphane?
propoxysilane;trioctylphosphane has a molecular weight of 460.84 g/mol, XLogP of 9.24, 23 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for propoxysilane;trioctylphosphane is sourced from PubChem (CID 175291717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).