dichloro-(3-iodopropyl)-thiophen-2-ylsilane

C7H9Cl2ISSi — CID 119088499

IUPACdichloro-(3-iodopropyl)-thiophen-2-ylsilane
SMILESCl[Si](Cl)(CCCI)c1cccs1
InChIInChI=1S/C7H9Cl2ISSi/c8-12(9,6-2-4-10)7-3-1-5-11-7/h1,3,5H,2,4,6H2
InChIKeyQKRRWODJQCIKES-UHFFFAOYSA-N
MW351.11 g/mol
LogP3.70
Rot. Bonds4

About dichloro-(3-iodopropyl)-thiophen-2-ylsilane

dichloro-(3-iodopropyl)-thiophen-2-ylsilane (PubChem CID 119088499) has the molecular formula C7H9Cl2ISSi and a molecular weight of 351.11 g/mol. Its IUPAC name is dichloro-(3-iodopropyl)-thiophen-2-ylsilane.

Molecular Properties

Compound Namedichloro-(3-iodopropyl)-thiophen-2-ylsilane
PubChem CID119088499
Molecular FormulaC7H9Cl2ISSi
Molecular Weight351.11 g/mol
Exact Mass349.86
IUPAC Namedichloro-(3-iodopropyl)-thiophen-2-ylsilane
SMILESCl[Si](Cl)(CCCI)c1cccs1
InChIInChI=1S/C7H9Cl2ISSi/c8-12(9,6-2-4-10)7-3-1-5-11-7/h1,3,5H,2,4,6H2
InChIKeyQKRRWODJQCIKES-UHFFFAOYSA-N
XLogP3.70
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.11
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', '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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Frequently Asked Questions

What is the IUPAC name of dichloro-(3-iodopropyl)-thiophen-2-ylsilane?
The IUPAC name of dichloro-(3-iodopropyl)-thiophen-2-ylsilane (CID 119088499) is dichloro-(3-iodopropyl)-thiophen-2-ylsilane.
What is the SMILES notation for dichloro-(3-iodopropyl)-thiophen-2-ylsilane?
The canonical SMILES for dichloro-(3-iodopropyl)-thiophen-2-ylsilane is Cl[Si](Cl)(CCCI)c1cccs1.
What is the InChIKey of dichloro-(3-iodopropyl)-thiophen-2-ylsilane?
The InChIKey is QKRRWODJQCIKES-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9Cl2ISSi/c8-12(9,6-2-4-10)7-3-1-5-11-7/h1,3,5H,2,4,6H2.
What are the key properties of dichloro-(3-iodopropyl)-thiophen-2-ylsilane?
dichloro-(3-iodopropyl)-thiophen-2-ylsilane has a molecular weight of 351.11 g/mol, XLogP of 3.70, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dichloro-(3-iodopropyl)-thiophen-2-ylsilane is sourced from PubChem (CID 119088499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).