chloromethyl(prop-2-enyl)silane

C4H9ClSi — CID 71349719

IUPACchloromethyl(prop-2-enyl)silane
SMILESC=CC[SiH2]CCl
InChIInChI=1S/C4H9ClSi/c1-2-3-6-4-5/h2H,1,3-4,6H2
InChIKeyMVMXHLNJYUGHMV-UHFFFAOYSA-N
MW120.66 g/mol
LogP0.96
Rot. Bonds3

About chloromethyl(prop-2-enyl)silane

chloromethyl(prop-2-enyl)silane (PubChem CID 71349719) has the molecular formula C4H9ClSi and a molecular weight of 120.66 g/mol. Its IUPAC name is chloromethyl(prop-2-enyl)silane.

Molecular Properties

Compound Namechloromethyl(prop-2-enyl)silane
PubChem CID71349719
Molecular FormulaC4H9ClSi
Molecular Weight120.66 g/mol
Exact Mass120.02
IUPAC Namechloromethyl(prop-2-enyl)silane
SMILESC=CC[SiH2]CCl
InChIInChI=1S/C4H9ClSi/c1-2-3-6-4-5/h2H,1,3-4,6H2
InChIKeyMVMXHLNJYUGHMV-UHFFFAOYSA-N
XLogP0.96
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.66
LogP ≤ 50.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of chloromethyl(prop-2-enyl)silane?
The IUPAC name of chloromethyl(prop-2-enyl)silane (CID 71349719) is chloromethyl(prop-2-enyl)silane.
What is the SMILES notation for chloromethyl(prop-2-enyl)silane?
The canonical SMILES for chloromethyl(prop-2-enyl)silane is C=CC[SiH2]CCl.
What is the InChIKey of chloromethyl(prop-2-enyl)silane?
The InChIKey is MVMXHLNJYUGHMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9ClSi/c1-2-3-6-4-5/h2H,1,3-4,6H2.
What are the key properties of chloromethyl(prop-2-enyl)silane?
chloromethyl(prop-2-enyl)silane has a molecular weight of 120.66 g/mol, XLogP of 0.96, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloromethyl(prop-2-enyl)silane is sourced from PubChem (CID 71349719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).