trichloro(hexan-2-yloxy)silane

C6H13Cl3OSi — CID 139637933

IUPACtrichloro(hexan-2-yloxy)silane
SMILESCCCCC(C)O[Si](Cl)(Cl)Cl
InChIInChI=1S/C6H13Cl3OSi/c1-3-4-5-6(2)10-11(7,8)9/h6H,3-5H2,1-2H3
InChIKeyLJWCFIIFSSIJPE-UHFFFAOYSA-N
MW235.61 g/mol
LogP3.73
Rot. Bonds5

About trichloro(hexan-2-yloxy)silane

trichloro(hexan-2-yloxy)silane (PubChem CID 139637933) has the molecular formula C6H13Cl3OSi and a molecular weight of 235.61 g/mol. Its IUPAC name is trichloro(hexan-2-yloxy)silane.

Molecular Properties

Compound Nametrichloro(hexan-2-yloxy)silane
PubChem CID139637933
Molecular FormulaC6H13Cl3OSi
Molecular Weight235.61 g/mol
Exact Mass233.98
IUPAC Nametrichloro(hexan-2-yloxy)silane
SMILESCCCCC(C)O[Si](Cl)(Cl)Cl
InChIInChI=1S/C6H13Cl3OSi/c1-3-4-5-6(2)10-11(7,8)9/h6H,3-5H2,1-2H3
InChIKeyLJWCFIIFSSIJPE-UHFFFAOYSA-N
XLogP3.73
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.61
LogP ≤ 53.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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

Trichloro(hexyloxy)silane
CID 524762
Trichloro(pentyloxy)silane
CID 524763
Trichloro(cyclopentyloxy)silane
CID 19913319
Trichloro(cyclohexyloxy)silane
CID 54361415
Dichloro-cyclohexyloxy-methoxysilane
CID 69285897
Chloro(hexan-3-yloxy)silane
CID 123199629
CID 139999097
CID 139999097
Dichloro(hexan-2-yloxy)silane
CID 173651341
Trichloro(pentan-2-yloxy)silane
CID 119096384

Frequently Asked Questions

What is the IUPAC name of trichloro(hexan-2-yloxy)silane?
The IUPAC name of trichloro(hexan-2-yloxy)silane (CID 139637933) is trichloro(hexan-2-yloxy)silane.
What is the SMILES notation for trichloro(hexan-2-yloxy)silane?
The canonical SMILES for trichloro(hexan-2-yloxy)silane is CCCCC(C)O[Si](Cl)(Cl)Cl.
What is the InChIKey of trichloro(hexan-2-yloxy)silane?
The InChIKey is LJWCFIIFSSIJPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13Cl3OSi/c1-3-4-5-6(2)10-11(7,8)9/h6H,3-5H2,1-2H3.
What are the key properties of trichloro(hexan-2-yloxy)silane?
trichloro(hexan-2-yloxy)silane has a molecular weight of 235.61 g/mol, XLogP of 3.73, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trichloro(hexan-2-yloxy)silane is sourced from PubChem (CID 139637933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).