methyl 2,4,4,6,6,8,8,10,10-nonamethyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane-2-carboxylate

C11H30O7Si5 — CID 155757010

IUPACmethyl 2,4,4,6,6,8,8,10,10-nonamethyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane-2-carboxylate
SMILESCOC(=O)[Si]1(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O1
InChIInChI=1S/C11H30O7Si5/c1-13-11(12)23(10)17-21(6,7)15-19(2,3)14-20(4,5)16-22(8,9)18-23/h1-10H3
InChIKeyPSXFKCRLZAFRDM-UHFFFAOYSA-N
MW414.78 g/mol
LogP3.31
Rot. Bonds1

About methyl 2,4,4,6,6,8,8,10,10-nonamethyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane-2-carboxylate

methyl 2,4,4,6,6,8,8,10,10-nonamethyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane-2-carboxylate (PubChem CID 155757010) has the molecular formula C11H30O7Si5 and a molecular weight of 414.78 g/mol. Its IUPAC name is methyl 2,4,4,6,6,8,8,10,10-nonamethyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane-2-carboxylate.

Molecular Properties

Compound Namemethyl 2,4,4,6,6,8,8,10,10-nonamethyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane-2-carboxylate
PubChem CID155757010
Molecular FormulaC11H30O7Si5
Molecular Weight414.78 g/mol
Exact Mass414.08
IUPAC Namemethyl 2,4,4,6,6,8,8,10,10-nonamethyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane-2-carboxylate
SMILESCOC(=O)[Si]1(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O1
InChIInChI=1S/C11H30O7Si5/c1-13-11(12)23(10)17-21(6,7)15-19(2,3)14-20(4,5)16-22(8,9)18-23/h1-10H3
InChIKeyPSXFKCRLZAFRDM-UHFFFAOYSA-N
XLogP3.31
TPSA72.45 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.78
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze methyl 2,4,4,6,6,8,8,10,10-nonamethyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane-2-carboxylate with MolForge

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Related Compounds

1,3-Bis(carbomethoxy)tetramethyldisiloxane
CID 2756718
Methyl [[methoxy(dimethyl)silyl]oxy-dimethylsilyl]formate
CID 59090477
Methyl [[[bis(methoxycarbonyl)-methylsilyl]oxy-dimethylsilyl]oxy-methoxycarbonyl-methylsilyl]formate
CID 59184947
Methyl (methoxycarbonyl-methyl-trimethylsilyloxysilyl)formate
CID 87757512
Methyl 2,4,4,6,6,8,8-heptamethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane-2-carboxylate
CID 140265251
[[Formyloxymethyl(dimethyl)silyl]oxy-dimethylsilyl]methyl formate
CID 154139295

Frequently Asked Questions

What is the IUPAC name of methyl 2,4,4,6,6,8,8,10,10-nonamethyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane-2-carboxylate?
The IUPAC name of methyl 2,4,4,6,6,8,8,10,10-nonamethyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane-2-carboxylate (CID 155757010) is methyl 2,4,4,6,6,8,8,10,10-nonamethyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane-2-carboxylate.
What is the SMILES notation for methyl 2,4,4,6,6,8,8,10,10-nonamethyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane-2-carboxylate?
The canonical SMILES for methyl 2,4,4,6,6,8,8,10,10-nonamethyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane-2-carboxylate is COC(=O)[Si]1(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O[Si](C)(C)O1.
What is the InChIKey of methyl 2,4,4,6,6,8,8,10,10-nonamethyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane-2-carboxylate?
The InChIKey is PSXFKCRLZAFRDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H30O7Si5/c1-13-11(12)23(10)17-21(6,7)15-19(2,3)14-20(4,5)16-22(8,9)18-23/h1-10H3.
What are the key properties of methyl 2,4,4,6,6,8,8,10,10-nonamethyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane-2-carboxylate?
methyl 2,4,4,6,6,8,8,10,10-nonamethyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane-2-carboxylate has a molecular weight of 414.78 g/mol, XLogP of 3.31, 1 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2,4,4,6,6,8,8,10,10-nonamethyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane-2-carboxylate is sourced from PubChem (CID 155757010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).