butoxy-dichloro-(chloromethyl)silane

C5H11Cl3OSi — CID 12030849

IUPACbutoxy-dichloro-(chloromethyl)silane
SMILESCCCCO[Si](Cl)(Cl)CCl
InChIInChI=1S/C5H11Cl3OSi/c1-2-3-4-9-10(7,8)5-6/h2-5H2,1H3
InChIKeyDYESEXQKRVHPQQ-UHFFFAOYSA-N
MW221.59 g/mol
LogP3.00
Rot. Bonds5

About butoxy-dichloro-(chloromethyl)silane

butoxy-dichloro-(chloromethyl)silane (PubChem CID 12030849) has the molecular formula C5H11Cl3OSi and a molecular weight of 221.59 g/mol. Its IUPAC name is butoxy-dichloro-(chloromethyl)silane.

Molecular Properties

Compound Namebutoxy-dichloro-(chloromethyl)silane
PubChem CID12030849
Molecular FormulaC5H11Cl3OSi
Molecular Weight221.59 g/mol
Exact Mass219.96
IUPAC Namebutoxy-dichloro-(chloromethyl)silane
SMILESCCCCO[Si](Cl)(Cl)CCl
InChIInChI=1S/C5H11Cl3OSi/c1-2-3-4-9-10(7,8)5-6/h2-5H2,1H3
InChIKeyDYESEXQKRVHPQQ-UHFFFAOYSA-N
XLogP3.00
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.59
LogP ≤ 53.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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': 'silicon_halogen', 'substructure': 'N/A'}

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Related Compounds

Ethylbutoxydichlorosilane
CID 598837
Dichloro(butoxy)-methylsilane
CID 12504657
Methylchloromethylethoxychlorosilane
CID 13827878
Chloro(chloromethyl)diethoxysilane
CID 22227254
Butoxydichloromethylsilane
CID 85701451
Chloromethyl dipropoxychlorosilane
CID 129803734
Butoxy(chloromethyl)silane
CID 129807420
1-Dichloromethyl(dimethyl)silyloxybutane
CID 554666
CID 14297378
CID 14297378
Chloro-(chloromethyl)-methyl-propan-2-yloxysilane
CID 85753966
Dichloro-methyl-propoxysilane
CID 87990062
CID 151591263
CID 151591263

Frequently Asked Questions

What is the IUPAC name of butoxy-dichloro-(chloromethyl)silane?
The IUPAC name of butoxy-dichloro-(chloromethyl)silane (CID 12030849) is butoxy-dichloro-(chloromethyl)silane.
What is the SMILES notation for butoxy-dichloro-(chloromethyl)silane?
The canonical SMILES for butoxy-dichloro-(chloromethyl)silane is CCCCO[Si](Cl)(Cl)CCl.
What is the InChIKey of butoxy-dichloro-(chloromethyl)silane?
The InChIKey is DYESEXQKRVHPQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11Cl3OSi/c1-2-3-4-9-10(7,8)5-6/h2-5H2,1H3.
What are the key properties of butoxy-dichloro-(chloromethyl)silane?
butoxy-dichloro-(chloromethyl)silane has a molecular weight of 221.59 g/mol, XLogP of 3.00, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for butoxy-dichloro-(chloromethyl)silane is sourced from PubChem (CID 12030849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).