3-(benzimidazol-1-yl)propyl-trichlorosilane

C10H11Cl3N2Si — CID 59630441

IUPAC3-(benzimidazol-1-yl)propyl-trichlorosilane
SMILESCl[Si](Cl)(Cl)CCCn1cnc2ccccc21
InChIInChI=1S/C10H11Cl3N2Si/c11-16(12,13)7-3-6-15-8-14-9-4-1-2-5-10(9)15/h1-2,4-5,8H,3,6-7H2
InChIKeyQVIYMLVAYKXZCH-UHFFFAOYSA-N
MW293.66 g/mol
LogP4.08
Rot. Bonds4

About 3-(benzimidazol-1-yl)propyl-trichlorosilane

3-(benzimidazol-1-yl)propyl-trichlorosilane (PubChem CID 59630441) has the molecular formula C10H11Cl3N2Si and a molecular weight of 293.66 g/mol. Its IUPAC name is 3-(benzimidazol-1-yl)propyl-trichlorosilane.

Molecular Properties

Compound Name3-(benzimidazol-1-yl)propyl-trichlorosilane
PubChem CID59630441
Molecular FormulaC10H11Cl3N2Si
Molecular Weight293.66 g/mol
Exact Mass291.98
IUPAC Name3-(benzimidazol-1-yl)propyl-trichlorosilane
SMILESCl[Si](Cl)(Cl)CCCn1cnc2ccccc21
InChIInChI=1S/C10H11Cl3N2Si/c11-16(12,13)7-3-6-15-8-14-9-4-1-2-5-10(9)15/h1-2,4-5,8H,3,6-7H2
InChIKeyQVIYMLVAYKXZCH-UHFFFAOYSA-N
XLogP4.08
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.66
LogP ≤ 54.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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

1-(6-chlorohexyl)benzimidazole
CID 62228178
1-[3-[3-(benzimidazol-1-yl)propyldisulfanyl]propyl]benzimidazole
CID 159358672
bis(1-butylbenzimidazole);ethane
CID 142164287
1-(18-phenyloctadecyl)benzimidazole
CID 67925718
3-(benzimidazol-1-yl)propyl-diethoxy-phenylsilane
CID 59630445
1-[2-[2-(benzimidazol-1-yl)ethoxy]ethyl]benzimidazole
CID 5190432
1-(3-ethylsulfanylpropyl)benzimidazole
CID 115650886
1-[2-[2-[2-(benzimidazol-1-yl)ethoxy]ethoxy]ethyl]benzimidazole
CID 2871878
N-[3-(benzimidazol-1-yl)propyl]-4-chlorobutanamide
CID 63308679
1-[3-(4-chlorophenyl)sulfanylpropyl]benzimidazole
CID 2966362
6-(benzimidazol-1-yl)hexane-1-sulfonic acid
CID 18415223
(E)-4-[3-(benzimidazol-1-yl)propylamino]-4-oxobut-2-enoic acid
CID 60940726

Frequently Asked Questions

What is the IUPAC name of 3-(benzimidazol-1-yl)propyl-trichlorosilane?
The IUPAC name of 3-(benzimidazol-1-yl)propyl-trichlorosilane (CID 59630441) is 3-(benzimidazol-1-yl)propyl-trichlorosilane.
What is the SMILES notation for 3-(benzimidazol-1-yl)propyl-trichlorosilane?
The canonical SMILES for 3-(benzimidazol-1-yl)propyl-trichlorosilane is Cl[Si](Cl)(Cl)CCCn1cnc2ccccc21.
What is the InChIKey of 3-(benzimidazol-1-yl)propyl-trichlorosilane?
The InChIKey is QVIYMLVAYKXZCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11Cl3N2Si/c11-16(12,13)7-3-6-15-8-14-9-4-1-2-5-10(9)15/h1-2,4-5,8H,3,6-7H2.
What are the key properties of 3-(benzimidazol-1-yl)propyl-trichlorosilane?
3-(benzimidazol-1-yl)propyl-trichlorosilane has a molecular weight of 293.66 g/mol, XLogP of 4.08, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(benzimidazol-1-yl)propyl-trichlorosilane is sourced from PubChem (CID 59630441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).