tert-butyl-dimethyl-tridecoxysilane

C19H42OSi — CID 6430224

IUPACtert-butyl-dimethyl-tridecoxysilane
SMILESCCCCCCCCCCCCCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C19H42OSi/c1-7-8-9-10-11-12-13-14-15-16-17-18-20-21(5,6)19(2,3)4/h7-18H2,1-6H3
InChIKeyYIZAVXUIXCTEBP-UHFFFAOYSA-N
MW314.63 g/mol
LogP7.32
Rot. Bonds13

About tert-butyl-dimethyl-tridecoxysilane

tert-butyl-dimethyl-tridecoxysilane (PubChem CID 6430224) has the molecular formula C19H42OSi and a molecular weight of 314.63 g/mol. Its IUPAC name is tert-butyl-dimethyl-tridecoxysilane.

Molecular Properties

Compound Nametert-butyl-dimethyl-tridecoxysilane
PubChem CID6430224
Molecular FormulaC19H42OSi
Molecular Weight314.63 g/mol
Exact Mass314.30
IUPAC Nametert-butyl-dimethyl-tridecoxysilane
SMILESCCCCCCCCCCCCCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C19H42OSi/c1-7-8-9-10-11-12-13-14-15-16-17-18-20-21(5,6)19(2,3)4/h7-18H2,1-6H3
InChIKeyYIZAVXUIXCTEBP-UHFFFAOYSA-N
XLogP7.32
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds13
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500314.63
LogP ≤ 57.32
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 tert-butyl-dimethyl-tridecoxysilane?
The IUPAC name of tert-butyl-dimethyl-tridecoxysilane (CID 6430224) is tert-butyl-dimethyl-tridecoxysilane.
What is the SMILES notation for tert-butyl-dimethyl-tridecoxysilane?
The canonical SMILES for tert-butyl-dimethyl-tridecoxysilane is CCCCCCCCCCCCCO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-tridecoxysilane?
The InChIKey is YIZAVXUIXCTEBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H42OSi/c1-7-8-9-10-11-12-13-14-15-16-17-18-20-21(5,6)19(2,3)4/h7-18H2,1-6H3.
What are the key properties of tert-butyl-dimethyl-tridecoxysilane?
tert-butyl-dimethyl-tridecoxysilane has a molecular weight of 314.63 g/mol, XLogP of 7.32, 13 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-tridecoxysilane is sourced from PubChem (CID 6430224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).