tert-butyl-dimethoxy-tridecylsilane

C19H42O2Si — CID 18990666

IUPACtert-butyl-dimethoxy-tridecylsilane
SMILESCCCCCCCCCCCCC[Si](OC)(OC)C(C)(C)C
InChIInChI=1S/C19H42O2Si/c1-7-8-9-10-11-12-13-14-15-16-17-18-22(20-5,21-6)19(2,3)4/h7-18H2,1-6H3
InChIKeyKSUAFLILNAJLNH-UHFFFAOYSA-N
MW330.63 g/mol
LogP6.83
Rot. Bonds14

About tert-butyl-dimethoxy-tridecylsilane

tert-butyl-dimethoxy-tridecylsilane (PubChem CID 18990666) has the molecular formula C19H42O2Si and a molecular weight of 330.63 g/mol. Its IUPAC name is tert-butyl-dimethoxy-tridecylsilane.

Molecular Properties

Compound Nametert-butyl-dimethoxy-tridecylsilane
PubChem CID18990666
Molecular FormulaC19H42O2Si
Molecular Weight330.63 g/mol
Exact Mass330.30
IUPAC Nametert-butyl-dimethoxy-tridecylsilane
SMILESCCCCCCCCCCCCC[Si](OC)(OC)C(C)(C)C
InChIInChI=1S/C19H42O2Si/c1-7-8-9-10-11-12-13-14-15-16-17-18-22(20-5,21-6)19(2,3)4/h7-18H2,1-6H3
InChIKeyKSUAFLILNAJLNH-UHFFFAOYSA-N
XLogP6.83
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds14
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500330.63
LogP ≤ 56.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl-ethoxy-heptadecyl-methoxysilane
CID 18990695
tert-butyl-ethoxy-heptyl-methoxysilane
CID 18990691
hexane;bis(hexyl(trimethoxy)silane)
CID 175053771
trimethoxy(pentacontyl)silane
CID 87930715
hexacosyl(trimethoxy)silane
CID 150262252
dodecyl(trimethoxy)silane;octane
CID 174570785
decyl(trimethoxy)silane;hexyl(trimethoxy)silane
CID 22665206
hexadecyl-dimethoxy-(2,3,4-trimethylpentan-2-yl)silane
CID 139767546
trimethoxy(undecyl)silane;hydrobromide
CID 172731268
dodecyl(trimethoxy)silane;λ2-plumbane
CID 175120013
decyl-(3-ethyl-2,4-dimethylpentan-2-yl)-dimethoxysilane
CID 151840194
methoxy-dimethyl-nonylsilane
CID 58695494

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethoxy-tridecylsilane?
The IUPAC name of tert-butyl-dimethoxy-tridecylsilane (CID 18990666) is tert-butyl-dimethoxy-tridecylsilane.
What is the SMILES notation for tert-butyl-dimethoxy-tridecylsilane?
The canonical SMILES for tert-butyl-dimethoxy-tridecylsilane is CCCCCCCCCCCCC[Si](OC)(OC)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethoxy-tridecylsilane?
The InChIKey is KSUAFLILNAJLNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H42O2Si/c1-7-8-9-10-11-12-13-14-15-16-17-18-22(20-5,21-6)19(2,3)4/h7-18H2,1-6H3.
What are the key properties of tert-butyl-dimethoxy-tridecylsilane?
tert-butyl-dimethoxy-tridecylsilane has a molecular weight of 330.63 g/mol, XLogP of 6.83, 14 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethoxy-tridecylsilane is sourced from PubChem (CID 18990666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).