tert-butyl-dimethoxy-propoxysilane

C9H22O3Si — CID 139714542

IUPACtert-butyl-dimethoxy-propoxysilane
SMILESCCCO[Si](OC)(OC)C(C)(C)C
InChIInChI=1S/C9H22O3Si/c1-7-8-12-13(10-5,11-6)9(2,3)4/h7-8H2,1-6H3
InChIKeyDLPHWYZQTKMQLZ-UHFFFAOYSA-N
MW206.36 g/mol
LogP2.44
Rot. Bonds5

About tert-butyl-dimethoxy-propoxysilane

tert-butyl-dimethoxy-propoxysilane (PubChem CID 139714542) has the molecular formula C9H22O3Si and a molecular weight of 206.36 g/mol. Its IUPAC name is tert-butyl-dimethoxy-propoxysilane.

Molecular Properties

Compound Nametert-butyl-dimethoxy-propoxysilane
PubChem CID139714542
Molecular FormulaC9H22O3Si
Molecular Weight206.36 g/mol
Exact Mass206.13
IUPAC Nametert-butyl-dimethoxy-propoxysilane
SMILESCCCO[Si](OC)(OC)C(C)(C)C
InChIInChI=1S/C9H22O3Si/c1-7-8-12-13(10-5,11-6)9(2,3)4/h7-8H2,1-6H3
InChIKeyDLPHWYZQTKMQLZ-UHFFFAOYSA-N
XLogP2.44
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.36
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

tritert-butyl(propoxy)silane
CID 87144875
tripropoxy(3-tripropoxysilylpentan-3-yl)silane
CID 140582882
(3-ethyl-2-methylpentan-2-yl)-tripropoxysilane
CID 23432765
ditert-butyl dimethyl silicate;methyl tripropyl silicate
CID 87785051
dimethyl dipropyl silicate;hydrate
CID 174450535
2,3-dimethylbutan-2-yl-dimethoxy-pentoxysilane
CID 152706829
tert-butyl-[4-[tert-butyl(dipropoxy)silyl]butyl]-dipropoxysilane
CID 87144385
tert-butyl-[dimethoxy(methyl)silyl]oxy-dimethoxysilane
CID 141248707
methyl-(2-methylbutan-2-yl)-dipropoxysilane
CID 153327730
methoxy(trimethyl)silane;propoxy(tripropyl)silane
CID 141486227
dimethyl pentyl propyl silicate
CID 524721
butyl-methoxy-dipropoxysilane
CID 18672915

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethoxy-propoxysilane?
The IUPAC name of tert-butyl-dimethoxy-propoxysilane (CID 139714542) is tert-butyl-dimethoxy-propoxysilane.
What is the SMILES notation for tert-butyl-dimethoxy-propoxysilane?
The canonical SMILES for tert-butyl-dimethoxy-propoxysilane is CCCO[Si](OC)(OC)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethoxy-propoxysilane?
The InChIKey is DLPHWYZQTKMQLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H22O3Si/c1-7-8-12-13(10-5,11-6)9(2,3)4/h7-8H2,1-6H3.
What are the key properties of tert-butyl-dimethoxy-propoxysilane?
tert-butyl-dimethoxy-propoxysilane has a molecular weight of 206.36 g/mol, XLogP of 2.44, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethoxy-propoxysilane is sourced from PubChem (CID 139714542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).