butyl-dichloro-(2-methylprop-2-enoxy)silane

C8H16Cl2OSi — CID 87920812

IUPACbutyl-dichloro-(2-methylprop-2-enoxy)silane
SMILESC=C(C)CO[Si](Cl)(Cl)CCCC
InChIInChI=1S/C8H16Cl2OSi/c1-4-5-6-12(9,10)11-7-8(2)3/h2,4-7H2,1,3H3
InChIKeyGLCXGCZHRDZAKH-UHFFFAOYSA-N
MW227.21 g/mol
LogP3.80
Rot. Bonds6

About butyl-dichloro-(2-methylprop-2-enoxy)silane

butyl-dichloro-(2-methylprop-2-enoxy)silane (PubChem CID 87920812) has the molecular formula C8H16Cl2OSi and a molecular weight of 227.21 g/mol. Its IUPAC name is butyl-dichloro-(2-methylprop-2-enoxy)silane.

Molecular Properties

Compound Namebutyl-dichloro-(2-methylprop-2-enoxy)silane
PubChem CID87920812
Molecular FormulaC8H16Cl2OSi
Molecular Weight227.21 g/mol
Exact Mass226.03
IUPAC Namebutyl-dichloro-(2-methylprop-2-enoxy)silane
SMILESC=C(C)CO[Si](Cl)(Cl)CCCC
InChIInChI=1S/C8H16Cl2OSi/c1-4-5-6-12(9,10)11-7-8(2)3/h2,4-7H2,1,3H3
InChIKeyGLCXGCZHRDZAKH-UHFFFAOYSA-N
XLogP3.80
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.21
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'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 butyl-dichloro-(2-methylprop-2-enoxy)silane?
The IUPAC name of butyl-dichloro-(2-methylprop-2-enoxy)silane (CID 87920812) is butyl-dichloro-(2-methylprop-2-enoxy)silane.
What is the SMILES notation for butyl-dichloro-(2-methylprop-2-enoxy)silane?
The canonical SMILES for butyl-dichloro-(2-methylprop-2-enoxy)silane is C=C(C)CO[Si](Cl)(Cl)CCCC.
What is the InChIKey of butyl-dichloro-(2-methylprop-2-enoxy)silane?
The InChIKey is GLCXGCZHRDZAKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16Cl2OSi/c1-4-5-6-12(9,10)11-7-8(2)3/h2,4-7H2,1,3H3.
What are the key properties of butyl-dichloro-(2-methylprop-2-enoxy)silane?
butyl-dichloro-(2-methylprop-2-enoxy)silane has a molecular weight of 227.21 g/mol, XLogP of 3.80, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for butyl-dichloro-(2-methylprop-2-enoxy)silane is sourced from PubChem (CID 87920812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).