dodecoxy-dimethyl-octylsilane

C22H48OSi — CID 618139

IUPACdodecoxy-dimethyl-octylsilane
SMILESCCCCCCCCCCCCO[Si](C)(C)CCCCCCCC
InChIInChI=1S/C22H48OSi/c1-5-7-9-11-13-14-15-16-17-19-21-23-24(3,4)22-20-18-12-10-8-6-2/h5-22H2,1-4H3
InChIKeyRVCANALKIOSJOU-UHFFFAOYSA-N
MW356.71 g/mol
LogP8.49
Rot. Bonds19

About dodecoxy-dimethyl-octylsilane

dodecoxy-dimethyl-octylsilane (PubChem CID 618139) has the molecular formula C22H48OSi and a molecular weight of 356.71 g/mol. Its IUPAC name is dodecoxy-dimethyl-octylsilane.

Molecular Properties

Compound Namedodecoxy-dimethyl-octylsilane
PubChem CID618139
Molecular FormulaC22H48OSi
Molecular Weight356.71 g/mol
Exact Mass356.35
IUPAC Namedodecoxy-dimethyl-octylsilane
SMILESCCCCCCCCCCCCO[Si](C)(C)CCCCCCCC
InChIInChI=1S/C22H48OSi/c1-5-7-9-11-13-14-15-16-17-19-21-23-24(3,4)22-20-18-12-10-8-6-2/h5-22H2,1-4H3
InChIKeyRVCANALKIOSJOU-UHFFFAOYSA-N
XLogP8.49
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds19
Heavy Atoms24
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500356.71
LogP ≤ 58.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of dodecoxy-dimethyl-octylsilane?
The IUPAC name of dodecoxy-dimethyl-octylsilane (CID 618139) is dodecoxy-dimethyl-octylsilane.
What is the SMILES notation for dodecoxy-dimethyl-octylsilane?
The canonical SMILES for dodecoxy-dimethyl-octylsilane is CCCCCCCCCCCCO[Si](C)(C)CCCCCCCC.
What is the InChIKey of dodecoxy-dimethyl-octylsilane?
The InChIKey is RVCANALKIOSJOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H48OSi/c1-5-7-9-11-13-14-15-16-17-19-21-23-24(3,4)22-20-18-12-10-8-6-2/h5-22H2,1-4H3.
What are the key properties of dodecoxy-dimethyl-octylsilane?
dodecoxy-dimethyl-octylsilane has a molecular weight of 356.71 g/mol, XLogP of 8.49, 19 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dodecoxy-dimethyl-octylsilane is sourced from PubChem (CID 618139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).