(3,3-dimethoxy-5-methylhexoxy)silane

C9H22O3Si — CID 123226798

IUPAC(3,3-dimethoxy-5-methylhexoxy)silane
SMILESCOC(CCO[SiH3])(CC(C)C)OC
InChIInChI=1S/C9H22O3Si/c1-8(2)7-9(10-3,11-4)5-6-12-13/h8H,5-7H2,1-4,13H3
InChIKeyMDQYKOINTWWFAM-UHFFFAOYSA-N
MW206.36 g/mol
LogP0.71
Rot. Bonds7

About (3,3-dimethoxy-5-methylhexoxy)silane

(3,3-dimethoxy-5-methylhexoxy)silane (PubChem CID 123226798) has the molecular formula C9H22O3Si and a molecular weight of 206.36 g/mol. Its IUPAC name is (3,3-dimethoxy-5-methylhexoxy)silane.

Molecular Properties

Compound Name(3,3-dimethoxy-5-methylhexoxy)silane
PubChem CID123226798
Molecular FormulaC9H22O3Si
Molecular Weight206.36 g/mol
Exact Mass206.13
IUPAC Name(3,3-dimethoxy-5-methylhexoxy)silane
SMILESCOC(CCO[SiH3])(CC(C)C)OC
InChIInChI=1S/C9H22O3Si/c1-8(2)7-9(10-3,11-4)5-6-12-13/h8H,5-7H2,1-4,13H3
InChIKeyMDQYKOINTWWFAM-UHFFFAOYSA-N
XLogP0.71
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.36
LogP ≤ 50.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

(4,4-Dimethoxy-6-methylheptoxy)silane
CID 123929258
(1,1-Dimethoxy-2-methylhexoxy)silane
CID 173570528

Frequently Asked Questions

What is the IUPAC name of (3,3-dimethoxy-5-methylhexoxy)silane?
The IUPAC name of (3,3-dimethoxy-5-methylhexoxy)silane (CID 123226798) is (3,3-dimethoxy-5-methylhexoxy)silane.
What is the SMILES notation for (3,3-dimethoxy-5-methylhexoxy)silane?
The canonical SMILES for (3,3-dimethoxy-5-methylhexoxy)silane is COC(CCO[SiH3])(CC(C)C)OC.
What is the InChIKey of (3,3-dimethoxy-5-methylhexoxy)silane?
The InChIKey is MDQYKOINTWWFAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H22O3Si/c1-8(2)7-9(10-3,11-4)5-6-12-13/h8H,5-7H2,1-4,13H3.
What are the key properties of (3,3-dimethoxy-5-methylhexoxy)silane?
(3,3-dimethoxy-5-methylhexoxy)silane has a molecular weight of 206.36 g/mol, XLogP of 0.71, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3,3-dimethoxy-5-methylhexoxy)silane is sourced from PubChem (CID 123226798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).