dichloromethyl-dimethyl-pentan-2-yloxysilane

C8H18Cl2OSi — CID 554338

IUPACdichloromethyl-dimethyl-pentan-2-yloxysilane
SMILESCCCC(C)O[Si](C)(C)C(Cl)Cl
InChIInChI=1S/C8H18Cl2OSi/c1-5-6-7(2)11-12(3,4)8(9)10/h7-8H,5-6H2,1-4H3
InChIKeyYZIBGCBQZHYOBR-UHFFFAOYSA-N
MW229.22 g/mol
LogP3.74
Rot. Bonds5

About dichloromethyl-dimethyl-pentan-2-yloxysilane

dichloromethyl-dimethyl-pentan-2-yloxysilane (PubChem CID 554338) has the molecular formula C8H18Cl2OSi and a molecular weight of 229.22 g/mol. Its IUPAC name is dichloromethyl-dimethyl-pentan-2-yloxysilane.

Molecular Properties

Compound Namedichloromethyl-dimethyl-pentan-2-yloxysilane
PubChem CID554338
Molecular FormulaC8H18Cl2OSi
Molecular Weight229.22 g/mol
Exact Mass228.05
IUPAC Namedichloromethyl-dimethyl-pentan-2-yloxysilane
SMILESCCCC(C)O[Si](C)(C)C(Cl)Cl
InChIInChI=1S/C8H18Cl2OSi/c1-5-6-7(2)11-12(3,4)8(9)10/h7-8H,5-6H2,1-4H3
InChIKeyYZIBGCBQZHYOBR-UHFFFAOYSA-N
XLogP3.74
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.22
LogP ≤ 53.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Methyl(dichloromethyl)diisopropoxysilane
CID 129818516
4-Dichloromethyl(dimethyl)silyloxyoctane
CID 554622
2-Dichloromethyl(dimethyl)silyloxypropane
CID 554626
1-Dichloromethyl(dimethyl)silyloxybutane
CID 554666
2-Dimethyl(dichloromethyl)silyloxybutane
CID 554681
(Dichloromethyl)(dimethyl)(pentyloxy)silane
CID 554701
2-Dimethyl(chloromethyl)silyloxypentane
CID 554714
1,1-Dichloro-2-trimethylsiloxypentane
CID 101624330

Frequently Asked Questions

What is the IUPAC name of dichloromethyl-dimethyl-pentan-2-yloxysilane?
The IUPAC name of dichloromethyl-dimethyl-pentan-2-yloxysilane (CID 554338) is dichloromethyl-dimethyl-pentan-2-yloxysilane.
What is the SMILES notation for dichloromethyl-dimethyl-pentan-2-yloxysilane?
The canonical SMILES for dichloromethyl-dimethyl-pentan-2-yloxysilane is CCCC(C)O[Si](C)(C)C(Cl)Cl.
What is the InChIKey of dichloromethyl-dimethyl-pentan-2-yloxysilane?
The InChIKey is YZIBGCBQZHYOBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18Cl2OSi/c1-5-6-7(2)11-12(3,4)8(9)10/h7-8H,5-6H2,1-4H3.
What are the key properties of dichloromethyl-dimethyl-pentan-2-yloxysilane?
dichloromethyl-dimethyl-pentan-2-yloxysilane has a molecular weight of 229.22 g/mol, XLogP of 3.74, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dichloromethyl-dimethyl-pentan-2-yloxysilane is sourced from PubChem (CID 554338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).