butan-2-yloxy-(dichloromethyl)-dimethylsilane

C7H16Cl2OSi — CID 554681

IUPACbutan-2-yloxy-(dichloromethyl)-dimethylsilane
SMILESCCC(C)O[Si](C)(C)C(Cl)Cl
InChIInChI=1S/C7H16Cl2OSi/c1-5-6(2)10-11(3,4)7(8)9/h6-7H,5H2,1-4H3
InChIKeyWTUCKMOCGPILGQ-UHFFFAOYSA-N
MW215.20 g/mol
LogP3.35
Rot. Bonds4

About butan-2-yloxy-(dichloromethyl)-dimethylsilane

butan-2-yloxy-(dichloromethyl)-dimethylsilane (PubChem CID 554681) has the molecular formula C7H16Cl2OSi and a molecular weight of 215.20 g/mol. Its IUPAC name is butan-2-yloxy-(dichloromethyl)-dimethylsilane.

Molecular Properties

Compound Namebutan-2-yloxy-(dichloromethyl)-dimethylsilane
PubChem CID554681
Molecular FormulaC7H16Cl2OSi
Molecular Weight215.20 g/mol
Exact Mass214.03
IUPAC Namebutan-2-yloxy-(dichloromethyl)-dimethylsilane
SMILESCCC(C)O[Si](C)(C)C(Cl)Cl
InChIInChI=1S/C7H16Cl2OSi/c1-5-6(2)10-11(3,4)7(8)9/h6-7H,5H2,1-4H3
InChIKeyWTUCKMOCGPILGQ-UHFFFAOYSA-N
XLogP3.35
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.20
LogP ≤ 53.35
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

(Chloromethyl)dimethylisopropoxysilane
CID 266137
Chloromethylmethyldiisopropoxysilane
CID 13107500
3-(Dichloromethyl)dimethylsilyloxyhex-4-yne
CID 531251
Dichloromethyldimethylsilyloxycyclobutane
CID 568135
Methyl(dichloromethyl)diisopropoxysilane
CID 129818516
2-Dichloromethyl(dimethyl)silyloxypentane
CID 554338
2-Dichloromethyl(dimethyl)silyloxypropane
CID 554626
1-Dimethyl(dichloromethyl)silyloxypropane
CID 554638
1-Dichloromethyl(dimethyl)silyloxybutane
CID 554666
2-Methyl-1-dimethyl(dichloromethyl)silyloxypropane
CID 554669
2-Dimethyl(chloromethyl)silyloxybutane
CID 554676
(Chloromethyl)bis(propan-2-yloxy)silane
CID 19770306

Frequently Asked Questions

What is the IUPAC name of butan-2-yloxy-(dichloromethyl)-dimethylsilane?
The IUPAC name of butan-2-yloxy-(dichloromethyl)-dimethylsilane (CID 554681) is butan-2-yloxy-(dichloromethyl)-dimethylsilane.
What is the SMILES notation for butan-2-yloxy-(dichloromethyl)-dimethylsilane?
The canonical SMILES for butan-2-yloxy-(dichloromethyl)-dimethylsilane is CCC(C)O[Si](C)(C)C(Cl)Cl.
What is the InChIKey of butan-2-yloxy-(dichloromethyl)-dimethylsilane?
The InChIKey is WTUCKMOCGPILGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16Cl2OSi/c1-5-6(2)10-11(3,4)7(8)9/h6-7H,5H2,1-4H3.
What are the key properties of butan-2-yloxy-(dichloromethyl)-dimethylsilane?
butan-2-yloxy-(dichloromethyl)-dimethylsilane has a molecular weight of 215.20 g/mol, XLogP of 3.35, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for butan-2-yloxy-(dichloromethyl)-dimethylsilane is sourced from PubChem (CID 554681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).