bromo-tris(2-ethylhexyl)silane

C24H51BrSi — CID 178181691

IUPACbromo-tris(2-ethylhexyl)silane
SMILESCCCCC(CC)C[Si](Br)(CC(CC)CCCC)CC(CC)CCCC
InChIInChI=1S/C24H51BrSi/c1-7-13-16-22(10-4)19-26(25,20-23(11-5)17-14-8-2)21-24(12-6)18-15-9-3/h22-24H,7-21H2,1-6H3
InChIKeyLONDUHMVASDZED-UHFFFAOYSA-N
MW447.66 g/mol
LogP9.98
Rot. Bonds18

About bromo-tris(2-ethylhexyl)silane

bromo-tris(2-ethylhexyl)silane (PubChem CID 178181691) has the molecular formula C24H51BrSi and a molecular weight of 447.66 g/mol. Its IUPAC name is bromo-tris(2-ethylhexyl)silane.

Molecular Properties

Compound Namebromo-tris(2-ethylhexyl)silane
PubChem CID178181691
Molecular FormulaC24H51BrSi
Molecular Weight447.66 g/mol
Exact Mass446.29
IUPAC Namebromo-tris(2-ethylhexyl)silane
SMILESCCCCC(CC)C[Si](Br)(CC(CC)CCCC)CC(CC)CCCC
InChIInChI=1S/C24H51BrSi/c1-7-13-16-22(10-4)19-26(25,20-23(11-5)17-14-8-2)21-24(12-6)18-15-9-3/h22-24H,7-21H2,1-6H3
InChIKeyLONDUHMVASDZED-UHFFFAOYSA-N
XLogP9.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds18
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500447.66
LogP ≤ 59.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

[(2R)-2-ethylhexyl]-tris[(2S)-2-ethylhexyl]silane
CID 99771332
bis(2-ethylhexyl)-difluorosilane
CID 178181546
dichloro-bis[(2R)-2-ethylhexyl]silane
CID 99738317
5-ethylnonane;5-propylnonane
CID 157441807
CID 160955383
CID 160955383
(5S)-3,5-diethylnonane;methane
CID 159387669
(2S)-2-ethylhexan-1-amine
CID 6999997
chloro-(2-ethylhexacosyl)-dimethylsilane
CID 87449643
bromo-bis(2-ethylhexyl)gallane
CID 178181676
3-(heptan-3-ylsulfanylmethyl)heptane
CID 134593171
1-bromo-2-(bromomethyl)-4-ethyloctane
CID 79453093
7-ethyltetracosane
CID 22223872

Frequently Asked Questions

What is the IUPAC name of bromo-tris(2-ethylhexyl)silane?
The IUPAC name of bromo-tris(2-ethylhexyl)silane (CID 178181691) is bromo-tris(2-ethylhexyl)silane.
What is the SMILES notation for bromo-tris(2-ethylhexyl)silane?
The canonical SMILES for bromo-tris(2-ethylhexyl)silane is CCCCC(CC)C[Si](Br)(CC(CC)CCCC)CC(CC)CCCC.
What is the InChIKey of bromo-tris(2-ethylhexyl)silane?
The InChIKey is LONDUHMVASDZED-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H51BrSi/c1-7-13-16-22(10-4)19-26(25,20-23(11-5)17-14-8-2)21-24(12-6)18-15-9-3/h22-24H,7-21H2,1-6H3.
What are the key properties of bromo-tris(2-ethylhexyl)silane?
bromo-tris(2-ethylhexyl)silane has a molecular weight of 447.66 g/mol, XLogP of 9.98, 18 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bromo-tris(2-ethylhexyl)silane is sourced from PubChem (CID 178181691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).