trichloro(30-chlorotriacontyl)silane

C30H60Cl4Si — CID 87686341

IUPACtrichloro(30-chlorotriacontyl)silane
SMILESClCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC[Si](Cl)(Cl)Cl
InChIInChI=1S/C30H60Cl4Si/c31-29-27-25-23-21-19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18-20-22-24-26-28-30-35(32,33)34/h1-30H2
InChIKeyXOFDMCBQEWJMSO-UHFFFAOYSA-N
MW590.71 g/mol
LogP13.80
Rot. Bonds30

About trichloro(30-chlorotriacontyl)silane

trichloro(30-chlorotriacontyl)silane (PubChem CID 87686341) has the molecular formula C30H60Cl4Si and a molecular weight of 590.71 g/mol. Its IUPAC name is trichloro(30-chlorotriacontyl)silane.

Molecular Properties

Compound Nametrichloro(30-chlorotriacontyl)silane
PubChem CID87686341
Molecular FormulaC30H60Cl4Si
Molecular Weight590.71 g/mol
Exact Mass588.32
IUPAC Nametrichloro(30-chlorotriacontyl)silane
SMILESClCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC[Si](Cl)(Cl)Cl
InChIInChI=1S/C30H60Cl4Si/c31-29-27-25-23-21-19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18-20-22-24-26-28-30-35(32,33)34/h1-30H2
InChIKeyXOFDMCBQEWJMSO-UHFFFAOYSA-N
XLogP13.80
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds30
Heavy Atoms35
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500590.71
LogP ≤ 513.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

trichloro(9-trichlorosilylnonyl)silane
CID 10172893
trichloro(3-chloropropyl)silane;trichloro(octyl)silane
CID 87989801
chloro-(24-chlorotetracosyl)-dimethylsilane
CID 87683150
35-trichlorosilylpentatriacontan-1-ol
CID 87683942
5-trichlorosilylpentane-1-thiol
CID 140708886
23-trichlorosilyltricosan-1-ol
CID 87680976
8-trichlorosilyloctane-1-thiol
CID 87461786
trichloro(octyl)silane
CID 21354
38-trichlorosilyloctatriacontan-1-ol
CID 87686206
38-trichlorosilyloctatriacontan-1-amine
CID 87683970
trichloro(25-iodopentacosyl)silane
CID 87682912
alumane;1,8-dichlorooctane
CID 173313045

Frequently Asked Questions

What is the IUPAC name of trichloro(30-chlorotriacontyl)silane?
The IUPAC name of trichloro(30-chlorotriacontyl)silane (CID 87686341) is trichloro(30-chlorotriacontyl)silane.
What is the SMILES notation for trichloro(30-chlorotriacontyl)silane?
The canonical SMILES for trichloro(30-chlorotriacontyl)silane is ClCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC[Si](Cl)(Cl)Cl.
What is the InChIKey of trichloro(30-chlorotriacontyl)silane?
The InChIKey is XOFDMCBQEWJMSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H60Cl4Si/c31-29-27-25-23-21-19-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-18-20-22-24-26-28-30-35(32,33)34/h1-30H2.
What are the key properties of trichloro(30-chlorotriacontyl)silane?
trichloro(30-chlorotriacontyl)silane has a molecular weight of 590.71 g/mol, XLogP of 13.80, 30 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trichloro(30-chlorotriacontyl)silane is sourced from PubChem (CID 87686341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).