dibutoxy-(chloromethyl)-methylsilane

C10H23ClO2Si — CID 19078520

IUPACdibutoxy-(chloromethyl)-methylsilane
SMILESCCCCO[Si](C)(CCl)OCCCC
InChIInChI=1S/C10H23ClO2Si/c1-4-6-8-12-14(3,10-11)13-9-7-5-2/h4-10H2,1-3H3
InChIKeyLZWZZJOKENRPNB-UHFFFAOYSA-N
MW238.83 g/mol
LogP3.47
Rot. Bonds9

About dibutoxy-(chloromethyl)-methylsilane

dibutoxy-(chloromethyl)-methylsilane (PubChem CID 19078520) has the molecular formula C10H23ClO2Si and a molecular weight of 238.83 g/mol. Its IUPAC name is dibutoxy-(chloromethyl)-methylsilane.

Molecular Properties

Compound Namedibutoxy-(chloromethyl)-methylsilane
PubChem CID19078520
Molecular FormulaC10H23ClO2Si
Molecular Weight238.83 g/mol
Exact Mass238.12
IUPAC Namedibutoxy-(chloromethyl)-methylsilane
SMILESCCCCO[Si](C)(CCl)OCCCC
InChIInChI=1S/C10H23ClO2Si/c1-4-6-8-12-14(3,10-11)13-9-7-5-2/h4-10H2,1-3H3
InChIKeyLZWZZJOKENRPNB-UHFFFAOYSA-N
XLogP3.47
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.83
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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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Frequently Asked Questions

What is the IUPAC name of dibutoxy-(chloromethyl)-methylsilane?
The IUPAC name of dibutoxy-(chloromethyl)-methylsilane (CID 19078520) is dibutoxy-(chloromethyl)-methylsilane.
What is the SMILES notation for dibutoxy-(chloromethyl)-methylsilane?
The canonical SMILES for dibutoxy-(chloromethyl)-methylsilane is CCCCO[Si](C)(CCl)OCCCC.
What is the InChIKey of dibutoxy-(chloromethyl)-methylsilane?
The InChIKey is LZWZZJOKENRPNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23ClO2Si/c1-4-6-8-12-14(3,10-11)13-9-7-5-2/h4-10H2,1-3H3.
What are the key properties of dibutoxy-(chloromethyl)-methylsilane?
dibutoxy-(chloromethyl)-methylsilane has a molecular weight of 238.83 g/mol, XLogP of 3.47, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dibutoxy-(chloromethyl)-methylsilane is sourced from PubChem (CID 19078520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).