butyl-chloro-(3-chloropropyl)-methylsilane

C8H18Cl2Si — CID 57285915

IUPACbutyl-chloro-(3-chloropropyl)-methylsilane
SMILESCCCC[Si](C)(Cl)CCCCl
InChIInChI=1S/C8H18Cl2Si/c1-3-4-7-11(2,10)8-5-6-9/h3-8H2,1-2H3
InChIKeyLYFPJDOSBTWRSR-UHFFFAOYSA-N
MW213.22 g/mol
LogP4.23
Rot. Bonds6

About butyl-chloro-(3-chloropropyl)-methylsilane

butyl-chloro-(3-chloropropyl)-methylsilane (PubChem CID 57285915) has the molecular formula C8H18Cl2Si and a molecular weight of 213.22 g/mol. Its IUPAC name is butyl-chloro-(3-chloropropyl)-methylsilane.

Molecular Properties

Compound Namebutyl-chloro-(3-chloropropyl)-methylsilane
PubChem CID57285915
Molecular FormulaC8H18Cl2Si
Molecular Weight213.22 g/mol
Exact Mass212.06
IUPAC Namebutyl-chloro-(3-chloropropyl)-methylsilane
SMILESCCCC[Si](C)(Cl)CCCCl
InChIInChI=1S/C8H18Cl2Si/c1-3-4-7-11(2,10)8-5-6-9/h3-8H2,1-2H3
InChIKeyLYFPJDOSBTWRSR-UHFFFAOYSA-N
XLogP4.23
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.22
LogP ≤ 54.23
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'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of butyl-chloro-(3-chloropropyl)-methylsilane?
The IUPAC name of butyl-chloro-(3-chloropropyl)-methylsilane (CID 57285915) is butyl-chloro-(3-chloropropyl)-methylsilane.
What is the SMILES notation for butyl-chloro-(3-chloropropyl)-methylsilane?
The canonical SMILES for butyl-chloro-(3-chloropropyl)-methylsilane is CCCC[Si](C)(Cl)CCCCl.
What is the InChIKey of butyl-chloro-(3-chloropropyl)-methylsilane?
The InChIKey is LYFPJDOSBTWRSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18Cl2Si/c1-3-4-7-11(2,10)8-5-6-9/h3-8H2,1-2H3.
What are the key properties of butyl-chloro-(3-chloropropyl)-methylsilane?
butyl-chloro-(3-chloropropyl)-methylsilane has a molecular weight of 213.22 g/mol, XLogP of 4.23, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for butyl-chloro-(3-chloropropyl)-methylsilane is sourced from PubChem (CID 57285915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).