dibutoxy(2-chloroethyl)silane

C10H23ClO2Si — CID 152748306

IUPACdibutoxy(2-chloroethyl)silane
SMILESCCCCO[SiH](CCCl)OCCCC
InChIInChI=1S/C10H23ClO2Si/c1-3-5-8-12-14(10-7-11)13-9-6-4-2/h14H,3-10H2,1-2H3
InChIKeyRGMQNVDYKOKRQA-UHFFFAOYSA-N
MW238.83 g/mol
LogP3.08
Rot. Bonds10

About dibutoxy(2-chloroethyl)silane

dibutoxy(2-chloroethyl)silane (PubChem CID 152748306) has the molecular formula C10H23ClO2Si and a molecular weight of 238.83 g/mol. Its IUPAC name is dibutoxy(2-chloroethyl)silane.

Molecular Properties

Compound Namedibutoxy(2-chloroethyl)silane
PubChem CID152748306
Molecular FormulaC10H23ClO2Si
Molecular Weight238.83 g/mol
Exact Mass238.12
IUPAC Namedibutoxy(2-chloroethyl)silane
SMILESCCCCO[SiH](CCCl)OCCCC
InChIInChI=1S/C10H23ClO2Si/c1-3-5-8-12-14(10-7-11)13-9-6-4-2/h14H,3-10H2,1-2H3
InChIKeyRGMQNVDYKOKRQA-UHFFFAOYSA-N
XLogP3.08
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.83
LogP ≤ 53.08
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(2-chloroethyl)silane?
The IUPAC name of dibutoxy(2-chloroethyl)silane (CID 152748306) is dibutoxy(2-chloroethyl)silane.
What is the SMILES notation for dibutoxy(2-chloroethyl)silane?
The canonical SMILES for dibutoxy(2-chloroethyl)silane is CCCCO[SiH](CCCl)OCCCC.
What is the InChIKey of dibutoxy(2-chloroethyl)silane?
The InChIKey is RGMQNVDYKOKRQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23ClO2Si/c1-3-5-8-12-14(10-7-11)13-9-6-4-2/h14H,3-10H2,1-2H3.
What are the key properties of dibutoxy(2-chloroethyl)silane?
dibutoxy(2-chloroethyl)silane has a molecular weight of 238.83 g/mol, XLogP of 3.08, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dibutoxy(2-chloroethyl)silane is sourced from PubChem (CID 152748306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).