dicyanopropyl dichlorosilane

C5H5Cl2N2Si — CID 57225083

IUPAC—
SMILESN#CC(C#N)CC[Si](Cl)Cl
InChIInChI=1S/C5H5Cl2N2Si/c6-10(7)2-1-5(3-8)4-9/h5H,1-2H2
InChIKeyKMBCDENKUQJQKP-UHFFFAOYSA-N
MW192.10 g/mol
LogP2.01
Rot. Bonds3

About dicyanopropyl dichlorosilane

dicyanopropyl dichlorosilane (PubChem CID 57225083) has the molecular formula C5H5Cl2N2Si and a molecular weight of 192.10 g/mol.

Molecular Properties

Compound Namedicyanopropyl dichlorosilane
PubChem CID57225083
Molecular FormulaC5H5Cl2N2Si
Molecular Weight192.10 g/mol
Exact Mass190.96
IUPAC Name—
SMILESN#CC(C#N)CC[Si](Cl)Cl
InChIInChI=1S/C5H5Cl2N2Si/c6-10(7)2-1-5(3-8)4-9/h5H,1-2H2
InChIKeyKMBCDENKUQJQKP-UHFFFAOYSA-N
XLogP2.01
TPSA47.58 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.10
LogP ≤ 52.01
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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Frequently Asked Questions

What is the IUPAC name of dicyanopropyl dichlorosilane?
The IUPAC name of dicyanopropyl dichlorosilane (CID 57225083) is not available.
What is the SMILES notation for dicyanopropyl dichlorosilane?
The canonical SMILES for dicyanopropyl dichlorosilane is N#CC(C#N)CC[Si](Cl)Cl.
What is the InChIKey of dicyanopropyl dichlorosilane?
The InChIKey is KMBCDENKUQJQKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5Cl2N2Si/c6-10(7)2-1-5(3-8)4-9/h5H,1-2H2.
What are the key properties of dicyanopropyl dichlorosilane?
dicyanopropyl dichlorosilane has a molecular weight of 192.10 g/mol, XLogP of 2.01, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dicyanopropyl dichlorosilane is sourced from PubChem (CID 57225083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).