butoxy(chloromethyl)silane

C5H13ClOSi — CID 151591263

IUPACbutoxy(chloromethyl)silane
SMILESCCCCO[SiH2]CCl
InChIInChI=1S/C5H13ClOSi/c1-2-3-4-7-8-5-6/h2-5,8H2,1H3
InChIKeyQIOAHRXSXWMILU-UHFFFAOYSA-N
MW152.70 g/mol
LogP1.08
Rot. Bonds5

About butoxy(chloromethyl)silane

butoxy(chloromethyl)silane (PubChem CID 151591263) has the molecular formula C5H13ClOSi and a molecular weight of 152.70 g/mol. Its IUPAC name is butoxy(chloromethyl)silane.

Molecular Properties

Compound Namebutoxy(chloromethyl)silane
PubChem CID151591263
Molecular FormulaC5H13ClOSi
Molecular Weight152.70 g/mol
Exact Mass152.04
IUPAC Namebutoxy(chloromethyl)silane
SMILESCCCCO[SiH2]CCl
InChIInChI=1S/C5H13ClOSi/c1-2-3-4-7-8-5-6/h2-5,8H2,1H3
InChIKeyQIOAHRXSXWMILU-UHFFFAOYSA-N
XLogP1.08
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.70
LogP ≤ 51.08
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'}

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Related Compounds

Butoxy(chloromethyl)dimethylsilane
CID 266134
(Chloromethyl)(dimethyl)propoxysilane
CID 266136
Silane, butoxydichloro(chloromethyl)-
CID 12030849
Butoxydichloromethylsilane
CID 85701451
Butoxy(chloromethyl)silane
CID 129807420
Butoxy(methyl)silane
CID 101533211
Chloromethyl(dipropoxy)silane
CID 123494680
Chloromethyl(diethoxy)silane
CID 123714296
Dichloromethyl(propoxy)silane
CID 130836493
Chloromethyl(propan-2-yloxy)silane
CID 154096088
Chloromethyl(propoxy)silane
CID 154143726
Chloromethyl(ethoxy)silane
CID 154362782

Frequently Asked Questions

What is the IUPAC name of butoxy(chloromethyl)silane?
The IUPAC name of butoxy(chloromethyl)silane (CID 151591263) is butoxy(chloromethyl)silane.
What is the SMILES notation for butoxy(chloromethyl)silane?
The canonical SMILES for butoxy(chloromethyl)silane is CCCCO[SiH2]CCl.
What is the InChIKey of butoxy(chloromethyl)silane?
The InChIKey is QIOAHRXSXWMILU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13ClOSi/c1-2-3-4-7-8-5-6/h2-5,8H2,1H3.
What are the key properties of butoxy(chloromethyl)silane?
butoxy(chloromethyl)silane has a molecular weight of 152.70 g/mol, XLogP of 1.08, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for butoxy(chloromethyl)silane is sourced from PubChem (CID 151591263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).