chloro-dimethyl-[3-(2-methylprop-2-enoxy)propyl]silane

C9H19ClOSi — CID 23436656

IUPACchloro-dimethyl-[3-(2-methylprop-2-enoxy)propyl]silane
SMILESC=C(C)COCCC[Si](C)(C)Cl
InChIInChI=1S/C9H19ClOSi/c1-9(2)8-11-6-5-7-12(3,4)10/h1,5-8H2,2-4H3
InChIKeyGVAPIZKUVHQKIR-UHFFFAOYSA-N
MW206.79 g/mol
LogP3.41
Rot. Bonds6

About chloro-dimethyl-[3-(2-methylprop-2-enoxy)propyl]silane

chloro-dimethyl-[3-(2-methylprop-2-enoxy)propyl]silane (PubChem CID 23436656) has the molecular formula C9H19ClOSi and a molecular weight of 206.79 g/mol. Its IUPAC name is chloro-dimethyl-[3-(2-methylprop-2-enoxy)propyl]silane.

Molecular Properties

Compound Namechloro-dimethyl-[3-(2-methylprop-2-enoxy)propyl]silane
PubChem CID23436656
Molecular FormulaC9H19ClOSi
Molecular Weight206.79 g/mol
Exact Mass206.09
IUPAC Namechloro-dimethyl-[3-(2-methylprop-2-enoxy)propyl]silane
SMILESC=C(C)COCCC[Si](C)(C)Cl
InChIInChI=1S/C9H19ClOSi/c1-9(2)8-11-6-5-7-12(3,4)10/h1,5-8H2,2-4H3
InChIKeyGVAPIZKUVHQKIR-UHFFFAOYSA-N
XLogP3.41
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.79
LogP ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of chloro-dimethyl-[3-(2-methylprop-2-enoxy)propyl]silane?
The IUPAC name of chloro-dimethyl-[3-(2-methylprop-2-enoxy)propyl]silane (CID 23436656) is chloro-dimethyl-[3-(2-methylprop-2-enoxy)propyl]silane.
What is the SMILES notation for chloro-dimethyl-[3-(2-methylprop-2-enoxy)propyl]silane?
The canonical SMILES for chloro-dimethyl-[3-(2-methylprop-2-enoxy)propyl]silane is C=C(C)COCCC[Si](C)(C)Cl.
What is the InChIKey of chloro-dimethyl-[3-(2-methylprop-2-enoxy)propyl]silane?
The InChIKey is GVAPIZKUVHQKIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19ClOSi/c1-9(2)8-11-6-5-7-12(3,4)10/h1,5-8H2,2-4H3.
What are the key properties of chloro-dimethyl-[3-(2-methylprop-2-enoxy)propyl]silane?
chloro-dimethyl-[3-(2-methylprop-2-enoxy)propyl]silane has a molecular weight of 206.79 g/mol, XLogP of 3.41, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-dimethyl-[3-(2-methylprop-2-enoxy)propyl]silane is sourced from PubChem (CID 23436656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).