dichloromethyl-dimethyl-tridecan-6-yloxysilane

C16H34Cl2OSi — CID 554263

IUPACdichloromethyl-dimethyl-tridecan-6-yloxysilane
SMILESCCCCCCCC(CCCCC)O[Si](C)(C)C(Cl)Cl
InChIInChI=1S/C16H34Cl2OSi/c1-5-7-9-10-12-14-15(13-11-8-6-2)19-20(3,4)16(17)18/h15-16H,5-14H2,1-4H3
InChIKeyWWOYETWORJYBSJ-UHFFFAOYSA-N
MW341.44 g/mol
LogP6.86
Rot. Bonds13

About dichloromethyl-dimethyl-tridecan-6-yloxysilane

dichloromethyl-dimethyl-tridecan-6-yloxysilane (PubChem CID 554263) has the molecular formula C16H34Cl2OSi and a molecular weight of 341.44 g/mol. Its IUPAC name is dichloromethyl-dimethyl-tridecan-6-yloxysilane.

Molecular Properties

Compound Namedichloromethyl-dimethyl-tridecan-6-yloxysilane
PubChem CID554263
Molecular FormulaC16H34Cl2OSi
Molecular Weight341.44 g/mol
Exact Mass340.18
IUPAC Namedichloromethyl-dimethyl-tridecan-6-yloxysilane
SMILESCCCCCCCC(CCCCC)O[Si](C)(C)C(Cl)Cl
InChIInChI=1S/C16H34Cl2OSi/c1-5-7-9-10-12-14-15(13-11-8-6-2)19-20(3,4)16(17)18/h15-16H,5-14H2,1-4H3
InChIKeyWWOYETWORJYBSJ-UHFFFAOYSA-N
XLogP6.86
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds13
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500341.44
LogP ≤ 56.86
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

dimethyl-pentadecan-4-yloxy-propan-2-ylsilane
CID 554330
decan-5-yloxy(trimethyl)silane
CID 553210
dodecan-6-yloxy-ethyl-dimethylsilane
CID 536242
chloromethyl-dimethyl-tridecan-5-yloxysilane
CID 554244
dimethyl-tridecan-4-yloxy-trimethylsilylsilane
CID 590056
ethyl-dimethyl-tridecan-4-yloxysilane
CID 554753
ethyl-dimethyl-tetradecan-4-yloxysilane
CID 534475
ethenyl-dimethyl-tridecan-4-yloxysilane
CID 593808
dichloromethyl-(6-ethyloctan-3-yloxy)-dimethylsilane
CID 554418
trimethyl(1-trimethylsilyloxyoctan-3-yloxy)silane
CID 14213504
6-tricosan-6-yloxytricosane
CID 57279617
16-tetratriacontan-16-yloxytetratriacontane
CID 91150918

Frequently Asked Questions

What is the IUPAC name of dichloromethyl-dimethyl-tridecan-6-yloxysilane?
The IUPAC name of dichloromethyl-dimethyl-tridecan-6-yloxysilane (CID 554263) is dichloromethyl-dimethyl-tridecan-6-yloxysilane.
What is the SMILES notation for dichloromethyl-dimethyl-tridecan-6-yloxysilane?
The canonical SMILES for dichloromethyl-dimethyl-tridecan-6-yloxysilane is CCCCCCCC(CCCCC)O[Si](C)(C)C(Cl)Cl.
What is the InChIKey of dichloromethyl-dimethyl-tridecan-6-yloxysilane?
The InChIKey is WWOYETWORJYBSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34Cl2OSi/c1-5-7-9-10-12-14-15(13-11-8-6-2)19-20(3,4)16(17)18/h15-16H,5-14H2,1-4H3.
What are the key properties of dichloromethyl-dimethyl-tridecan-6-yloxysilane?
dichloromethyl-dimethyl-tridecan-6-yloxysilane has a molecular weight of 341.44 g/mol, XLogP of 6.86, 13 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dichloromethyl-dimethyl-tridecan-6-yloxysilane is sourced from PubChem (CID 554263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).