aniline;trichlorosilane

C6H8Cl3NSi — CID 162026079

IUPACaniline;trichlorosilane
SMILESCl[SiH](Cl)Cl.Nc1ccccc1
InChIInChI=1S/C6H7N.Cl3HSi/c7-6-4-2-1-3-5-6;1-4(2)3/h1-5H,7H2;4H
InChIKeyYVJTURVQHRRONB-UHFFFAOYSA-N
MW228.58 g/mol
LogP2.69
Rot. Bonds

About aniline;trichlorosilane

aniline;trichlorosilane (PubChem CID 162026079) has the molecular formula C6H8Cl3NSi and a molecular weight of 228.58 g/mol. Its IUPAC name is aniline;trichlorosilane.

Molecular Properties

Compound Nameaniline;trichlorosilane
PubChem CID162026079
Molecular FormulaC6H8Cl3NSi
Molecular Weight228.58 g/mol
Exact Mass226.95
IUPAC Nameaniline;trichlorosilane
SMILESCl[SiH](Cl)Cl.Nc1ccccc1
InChIInChI=1S/C6H7N.Cl3HSi/c7-6-4-2-1-3-5-6;1-4(2)3/h1-5H,7H2;4H
InChIKeyYVJTURVQHRRONB-UHFFFAOYSA-N
XLogP2.69
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.58
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'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 aniline;trichlorosilane?
The IUPAC name of aniline;trichlorosilane (CID 162026079) is aniline;trichlorosilane.
What is the SMILES notation for aniline;trichlorosilane?
The canonical SMILES for aniline;trichlorosilane is Cl[SiH](Cl)Cl.Nc1ccccc1.
What is the InChIKey of aniline;trichlorosilane?
The InChIKey is YVJTURVQHRRONB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N.Cl3HSi/c7-6-4-2-1-3-5-6;1-4(2)3/h1-5H,7H2;4H.
What are the key properties of aniline;trichlorosilane?
aniline;trichlorosilane has a molecular weight of 228.58 g/mol, XLogP of 2.69, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for aniline;trichlorosilane is sourced from PubChem (CID 162026079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).