2,3-dimethylbutan-2-yl-dimethoxy-pentoxysilane

C13H30O3Si — CID 152706829

IUPAC2,3-dimethylbutan-2-yl-dimethoxy-pentoxysilane
SMILESCCCCCO[Si](OC)(OC)C(C)(C)C(C)C
InChIInChI=1S/C13H30O3Si/c1-8-9-10-11-16-17(14-6,15-7)13(4,5)12(2)3/h12H,8-11H2,1-7H3
InChIKeyZSTFENTWVQGPDJ-UHFFFAOYSA-N
MW262.47 g/mol
LogP3.86
Rot. Bonds9

About 2,3-dimethylbutan-2-yl-dimethoxy-pentoxysilane

2,3-dimethylbutan-2-yl-dimethoxy-pentoxysilane (PubChem CID 152706829) has the molecular formula C13H30O3Si and a molecular weight of 262.47 g/mol. Its IUPAC name is 2,3-dimethylbutan-2-yl-dimethoxy-pentoxysilane.

Molecular Properties

Compound Name2,3-dimethylbutan-2-yl-dimethoxy-pentoxysilane
PubChem CID152706829
Molecular FormulaC13H30O3Si
Molecular Weight262.47 g/mol
Exact Mass262.20
IUPAC Name2,3-dimethylbutan-2-yl-dimethoxy-pentoxysilane
SMILESCCCCCO[Si](OC)(OC)C(C)(C)C(C)C
InChIInChI=1S/C13H30O3Si/c1-8-9-10-11-16-17(14-6,15-7)13(4,5)12(2)3/h12H,8-11H2,1-7H3
InChIKeyZSTFENTWVQGPDJ-UHFFFAOYSA-N
XLogP3.86
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.47
LogP ≤ 53.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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

methyl tripentyl silicate
CID 524731
tert-butyl-dimethoxy-propoxysilane
CID 139714542
dimethyl pentyl propyl silicate
CID 524721
fluoro(trihexoxy)silane
CID 139977145
dipentyl dipropan-2-yl silicate
CID 57239154
1-(2,3-dimethylbutan-2-yloxy)decane
CID 172756117
ethyl dimethyl pentyl silicate
CID 88851017
tert-butyl-hexacosoxy-dimethylsilane
CID 6430213
nonyl tripentyl silicate
CID 141280747
decyl trihexyl silicate
CID 141280760
dibutyl dipentyl silicate
CID 524713
triheptyl pentyl silicate
CID 141280740

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethylbutan-2-yl-dimethoxy-pentoxysilane?
The IUPAC name of 2,3-dimethylbutan-2-yl-dimethoxy-pentoxysilane (CID 152706829) is 2,3-dimethylbutan-2-yl-dimethoxy-pentoxysilane.
What is the SMILES notation for 2,3-dimethylbutan-2-yl-dimethoxy-pentoxysilane?
The canonical SMILES for 2,3-dimethylbutan-2-yl-dimethoxy-pentoxysilane is CCCCCO[Si](OC)(OC)C(C)(C)C(C)C.
What is the InChIKey of 2,3-dimethylbutan-2-yl-dimethoxy-pentoxysilane?
The InChIKey is ZSTFENTWVQGPDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H30O3Si/c1-8-9-10-11-16-17(14-6,15-7)13(4,5)12(2)3/h12H,8-11H2,1-7H3.
What are the key properties of 2,3-dimethylbutan-2-yl-dimethoxy-pentoxysilane?
2,3-dimethylbutan-2-yl-dimethoxy-pentoxysilane has a molecular weight of 262.47 g/mol, XLogP of 3.86, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethylbutan-2-yl-dimethoxy-pentoxysilane is sourced from PubChem (CID 152706829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).