ethoxy-dihexyl-iodosilane

C14H31IOSi — CID 154486979

IUPACethoxy-dihexyl-iodosilane
SMILESCCCCCC[Si](I)(CCCCCC)OCC
InChIInChI=1S/C14H31IOSi/c1-4-7-9-11-13-17(15,16-6-3)14-12-10-8-5-2/h4-14H2,1-3H3
InChIKeyZDHXSAODXNLPSZ-UHFFFAOYSA-N
MW370.39 g/mol
LogP6.06
Rot. Bonds12

About ethoxy-dihexyl-iodosilane

ethoxy-dihexyl-iodosilane (PubChem CID 154486979) has the molecular formula C14H31IOSi and a molecular weight of 370.39 g/mol. Its IUPAC name is ethoxy-dihexyl-iodosilane.

Molecular Properties

Compound Nameethoxy-dihexyl-iodosilane
PubChem CID154486979
Molecular FormulaC14H31IOSi
Molecular Weight370.39 g/mol
Exact Mass370.12
IUPAC Nameethoxy-dihexyl-iodosilane
SMILESCCCCCC[Si](I)(CCCCCC)OCC
InChIInChI=1S/C14H31IOSi/c1-4-7-9-11-13-17(15,16-6-3)14-12-10-8-5-2/h4-14H2,1-3H3
InChIKeyZDHXSAODXNLPSZ-UHFFFAOYSA-N
XLogP6.06
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds12
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.39
LogP ≤ 56.06
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': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'}

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Related Compounds

diethoxy-heptadecyl-pentadecylsilane
CID 139614360
dodecyl(triethoxy)silane;tridecane
CID 174970002
butyl-diethoxy-iodosilane
CID 154487050
triethoxy(henicosyl)silane
CID 141362894
diethoxy-hexadecyl-tridecylsilane
CID 139614117
diethoxy-icosyl-undecylsilane
CID 139614143
decyl-diethoxy-tridecylsilane
CID 139614334
triethoxy(nonyl)silane;triethoxy(octyl)silane
CID 175508301
triethoxy(nonyl)silane;hydrofluoride
CID 161088856
ethoxy-(ethoxy-hexyl-methylsilyl)-hexyl-methylsilane
CID 11110794
silane;triethoxy(tetradecyl)silane
CID 161365398
diethoxy-methyl-undecylsilane
CID 140884401

Frequently Asked Questions

What is the IUPAC name of ethoxy-dihexyl-iodosilane?
The IUPAC name of ethoxy-dihexyl-iodosilane (CID 154486979) is ethoxy-dihexyl-iodosilane.
What is the SMILES notation for ethoxy-dihexyl-iodosilane?
The canonical SMILES for ethoxy-dihexyl-iodosilane is CCCCCC[Si](I)(CCCCCC)OCC.
What is the InChIKey of ethoxy-dihexyl-iodosilane?
The InChIKey is ZDHXSAODXNLPSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H31IOSi/c1-4-7-9-11-13-17(15,16-6-3)14-12-10-8-5-2/h4-14H2,1-3H3.
What are the key properties of ethoxy-dihexyl-iodosilane?
ethoxy-dihexyl-iodosilane has a molecular weight of 370.39 g/mol, XLogP of 6.06, 12 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxy-dihexyl-iodosilane is sourced from PubChem (CID 154486979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).