2-dichloroboranylethyl(dichloromethyl)silane

C3H7BCl4Si — CID 131722619

IUPAC2-dichloroboranylethyl(dichloromethyl)silane
SMILESClB(Cl)CC[SiH2]C(Cl)Cl
InChIInChI=1S/C3H7BCl4Si/c5-3(6)9-2-1-4(7)8/h3H,1-2,9H2
InChIKeyOBVSCFKXZUHDOI-UHFFFAOYSA-N
MW223.80 g/mol
LogP2.30
Rot. Bonds4

About 2-dichloroboranylethyl(dichloromethyl)silane

2-dichloroboranylethyl(dichloromethyl)silane (PubChem CID 131722619) has the molecular formula C3H7BCl4Si and a molecular weight of 223.80 g/mol. Its IUPAC name is 2-dichloroboranylethyl(dichloromethyl)silane.

Molecular Properties

Compound Name2-dichloroboranylethyl(dichloromethyl)silane
PubChem CID131722619
Molecular FormulaC3H7BCl4Si
Molecular Weight223.80 g/mol
Exact Mass221.92
IUPAC Name2-dichloroboranylethyl(dichloromethyl)silane
SMILESClB(Cl)CC[SiH2]C(Cl)Cl
InChIInChI=1S/C3H7BCl4Si/c5-3(6)9-2-1-4(7)8/h3H,1-2,9H2
InChIKeyOBVSCFKXZUHDOI-UHFFFAOYSA-N
XLogP2.30
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.80
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-dichloroboranylethyl(dichloromethyl)silane?
The IUPAC name of 2-dichloroboranylethyl(dichloromethyl)silane (CID 131722619) is 2-dichloroboranylethyl(dichloromethyl)silane.
What is the SMILES notation for 2-dichloroboranylethyl(dichloromethyl)silane?
The canonical SMILES for 2-dichloroboranylethyl(dichloromethyl)silane is ClB(Cl)CC[SiH2]C(Cl)Cl.
What is the InChIKey of 2-dichloroboranylethyl(dichloromethyl)silane?
The InChIKey is OBVSCFKXZUHDOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7BCl4Si/c5-3(6)9-2-1-4(7)8/h3H,1-2,9H2.
What are the key properties of 2-dichloroboranylethyl(dichloromethyl)silane?
2-dichloroboranylethyl(dichloromethyl)silane has a molecular weight of 223.80 g/mol, XLogP of 2.30, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-dichloroboranylethyl(dichloromethyl)silane is sourced from PubChem (CID 131722619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).