dibutyl-hexyl-iodosilane

C14H31ISi — CID 154486871

IUPACdibutyl-hexyl-iodosilane
SMILESCCCCCC[Si](I)(CCCC)CCCC
InChIInChI=1S/C14H31ISi/c1-4-7-10-11-14-16(15,12-8-5-2)13-9-6-3/h4-14H2,1-3H3
InChIKeyAJSCQKQCYYCCCV-UHFFFAOYSA-N
MW354.39 g/mol
LogP6.55
Rot. Bonds11

About dibutyl-hexyl-iodosilane

dibutyl-hexyl-iodosilane (PubChem CID 154486871) has the molecular formula C14H31ISi and a molecular weight of 354.39 g/mol. Its IUPAC name is dibutyl-hexyl-iodosilane.

Molecular Properties

Compound Namedibutyl-hexyl-iodosilane
PubChem CID154486871
Molecular FormulaC14H31ISi
Molecular Weight354.39 g/mol
Exact Mass354.12
IUPAC Namedibutyl-hexyl-iodosilane
SMILESCCCCCC[Si](I)(CCCC)CCCC
InChIInChI=1S/C14H31ISi/c1-4-7-10-11-14-16(15,12-8-5-2)13-9-6-3/h4-14H2,1-3H3
InChIKeyAJSCQKQCYYCCCV-UHFFFAOYSA-N
XLogP6.55
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds11
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500354.39
LogP ≤ 56.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

trihexadecyl(iodo)silane
CID 172579370
butyl-iodo-dipropylsilane
CID 166025271
butyl-hexyl-diiodosilane
CID 140745011
butyl-dihexyl-octylsilane
CID 168803297
dichloro-iodo-octylsilane
CID 154486818
dibutyl-heptyl-methylsilane
CID 168803311
trifluoro(hexadecyl)silane
CID 141473475
trifluoro(tridecyl)silane
CID 537319
butyl-dimethyl-undecylsilane
CID 54018421
butyl-heptyl-methyl-octylsilane
CID 168803305
dibutyl(diiodo)silane
CID 19755165
bromo-butyl-dihexylsilane
CID 140744866

Frequently Asked Questions

What is the IUPAC name of dibutyl-hexyl-iodosilane?
The IUPAC name of dibutyl-hexyl-iodosilane (CID 154486871) is dibutyl-hexyl-iodosilane.
What is the SMILES notation for dibutyl-hexyl-iodosilane?
The canonical SMILES for dibutyl-hexyl-iodosilane is CCCCCC[Si](I)(CCCC)CCCC.
What is the InChIKey of dibutyl-hexyl-iodosilane?
The InChIKey is AJSCQKQCYYCCCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31ISi/c1-4-7-10-11-14-16(15,12-8-5-2)13-9-6-3/h4-14H2,1-3H3.
What are the key properties of dibutyl-hexyl-iodosilane?
dibutyl-hexyl-iodosilane has a molecular weight of 354.39 g/mol, XLogP of 6.55, 11 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dibutyl-hexyl-iodosilane is sourced from PubChem (CID 154486871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).