dichloro-phenyl-pyrrol-1-ylsilane

C10H9Cl2NSi — CID 102008806

IUPACdichloro-phenyl-pyrrol-1-ylsilane
SMILESCl[Si](Cl)(c1ccccc1)n1cccc1
InChIInChI=1S/C10H9Cl2NSi/c11-14(12,13-8-4-5-9-13)10-6-2-1-3-7-10/h1-9H
InChIKeyNGNIUPYUDNHIAG-UHFFFAOYSA-N
MW242.18 g/mol
LogP2.66
Rot. Bonds2

About dichloro-phenyl-pyrrol-1-ylsilane

dichloro-phenyl-pyrrol-1-ylsilane (PubChem CID 102008806) has the molecular formula C10H9Cl2NSi and a molecular weight of 242.18 g/mol. Its IUPAC name is dichloro-phenyl-pyrrol-1-ylsilane.

Molecular Properties

Compound Namedichloro-phenyl-pyrrol-1-ylsilane
PubChem CID102008806
Molecular FormulaC10H9Cl2NSi
Molecular Weight242.18 g/mol
Exact Mass240.99
IUPAC Namedichloro-phenyl-pyrrol-1-ylsilane
SMILESCl[Si](Cl)(c1ccccc1)n1cccc1
InChIInChI=1S/C10H9Cl2NSi/c11-14(12,13-8-4-5-9-13)10-6-2-1-3-7-10/h1-9H
InChIKeyNGNIUPYUDNHIAG-UHFFFAOYSA-N
XLogP2.66
TPSA4.93 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.18
LogP ≤ 52.66
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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Frequently Asked Questions

What is the IUPAC name of dichloro-phenyl-pyrrol-1-ylsilane?
The IUPAC name of dichloro-phenyl-pyrrol-1-ylsilane (CID 102008806) is dichloro-phenyl-pyrrol-1-ylsilane.
What is the SMILES notation for dichloro-phenyl-pyrrol-1-ylsilane?
The canonical SMILES for dichloro-phenyl-pyrrol-1-ylsilane is Cl[Si](Cl)(c1ccccc1)n1cccc1.
What is the InChIKey of dichloro-phenyl-pyrrol-1-ylsilane?
The InChIKey is NGNIUPYUDNHIAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9Cl2NSi/c11-14(12,13-8-4-5-9-13)10-6-2-1-3-7-10/h1-9H.
What are the key properties of dichloro-phenyl-pyrrol-1-ylsilane?
dichloro-phenyl-pyrrol-1-ylsilane has a molecular weight of 242.18 g/mol, XLogP of 2.66, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dichloro-phenyl-pyrrol-1-ylsilane is sourced from PubChem (CID 102008806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).