2,2,5,8,8,13,13,15,17,17-decamethyl-1,4,6,9,11,14,16,19-octaoxa-2,5,8,10,13,15,17-heptasilaspiro[9.9]nonadecane

C14H40O8Si7 — CID 161140203

IUPAC2,2,5,8,8,13,13,15,17,17-decamethyl-1,4,6,9,11,14,16,19-octaoxa-2,5,8,10,13,15,17-heptasilaspiro[9.9]nonadecane
SMILESC[SiH]1OC[Si](C)(C)O[Si]2(OC[Si](C)(C)O[SiH](C)O[Si](C)(C)CO2)O[Si](C)(C)CO1
InChIInChI=1S/C14H40O8Si7/c1-23-15-11-27(7,8)21-29(22-28(9,10)12-16-23)17-13-25(3,4)19-24(2)20-26(5,6)14-18-29/h23-24H,11-14H2,1-10H3
InChIKeyFVMBWBWEBRGXTE-UHFFFAOYSA-N
MW533.07 g/mol
LogP2.26
Rot. Bonds

About 2,2,5,8,8,13,13,15,17,17-decamethyl-1,4,6,9,11,14,16,19-octaoxa-2,5,8,10,13,15,17-heptasilaspiro[9.9]nonadecane

2,2,5,8,8,13,13,15,17,17-decamethyl-1,4,6,9,11,14,16,19-octaoxa-2,5,8,10,13,15,17-heptasilaspiro[9.9]nonadecane (PubChem CID 161140203) has the molecular formula C14H40O8Si7 and a molecular weight of 533.07 g/mol. Its IUPAC name is 2,2,5,8,8,13,13,15,17,17-decamethyl-1,4,6,9,11,14,16,19-octaoxa-2,5,8,10,13,15,17-heptasilaspiro[9.9]nonadecane.

Molecular Properties

Compound Name2,2,5,8,8,13,13,15,17,17-decamethyl-1,4,6,9,11,14,16,19-octaoxa-2,5,8,10,13,15,17-heptasilaspiro[9.9]nonadecane
PubChem CID161140203
Molecular FormulaC14H40O8Si7
Molecular Weight533.07 g/mol
Exact Mass532.11
IUPAC Name2,2,5,8,8,13,13,15,17,17-decamethyl-1,4,6,9,11,14,16,19-octaoxa-2,5,8,10,13,15,17-heptasilaspiro[9.9]nonadecane
SMILESC[SiH]1OC[Si](C)(C)O[Si]2(OC[Si](C)(C)O[SiH](C)O[Si](C)(C)CO2)O[Si](C)(C)CO1
InChIInChI=1S/C14H40O8Si7/c1-23-15-11-27(7,8)21-29(22-28(9,10)12-16-23)17-13-25(3,4)19-24(2)20-26(5,6)14-18-29/h23-24H,11-14H2,1-10H3
InChIKeyFVMBWBWEBRGXTE-UHFFFAOYSA-N
XLogP2.26
TPSA73.84 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500533.07
LogP ≤ 52.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

Analyze 2,2,5,8,8,13,13,15,17,17-decamethyl-1,4,6,9,11,14,16,19-octaoxa-2,5,8,10,13,15,17-heptasilaspiro[9.9]nonadecane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,2,5,8,8,13,13,15,17,17-decamethyl-1,4,6,9,11,14,16,19-octaoxa-2,5,8,10,13,15,17-heptasilaspiro[9.9]nonadecane?
The IUPAC name of 2,2,5,8,8,13,13,15,17,17-decamethyl-1,4,6,9,11,14,16,19-octaoxa-2,5,8,10,13,15,17-heptasilaspiro[9.9]nonadecane (CID 161140203) is 2,2,5,8,8,13,13,15,17,17-decamethyl-1,4,6,9,11,14,16,19-octaoxa-2,5,8,10,13,15,17-heptasilaspiro[9.9]nonadecane.
What is the SMILES notation for 2,2,5,8,8,13,13,15,17,17-decamethyl-1,4,6,9,11,14,16,19-octaoxa-2,5,8,10,13,15,17-heptasilaspiro[9.9]nonadecane?
The canonical SMILES for 2,2,5,8,8,13,13,15,17,17-decamethyl-1,4,6,9,11,14,16,19-octaoxa-2,5,8,10,13,15,17-heptasilaspiro[9.9]nonadecane is C[SiH]1OC[Si](C)(C)O[Si]2(OC[Si](C)(C)O[SiH](C)O[Si](C)(C)CO2)O[Si](C)(C)CO1.
What is the InChIKey of 2,2,5,8,8,13,13,15,17,17-decamethyl-1,4,6,9,11,14,16,19-octaoxa-2,5,8,10,13,15,17-heptasilaspiro[9.9]nonadecane?
The InChIKey is FVMBWBWEBRGXTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H40O8Si7/c1-23-15-11-27(7,8)21-29(22-28(9,10)12-16-23)17-13-25(3,4)19-24(2)20-26(5,6)14-18-29/h23-24H,11-14H2,1-10H3.
What are the key properties of 2,2,5,8,8,13,13,15,17,17-decamethyl-1,4,6,9,11,14,16,19-octaoxa-2,5,8,10,13,15,17-heptasilaspiro[9.9]nonadecane?
2,2,5,8,8,13,13,15,17,17-decamethyl-1,4,6,9,11,14,16,19-octaoxa-2,5,8,10,13,15,17-heptasilaspiro[9.9]nonadecane has a molecular weight of 533.07 g/mol, XLogP of 2.26, 0 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,5,8,8,13,13,15,17,17-decamethyl-1,4,6,9,11,14,16,19-octaoxa-2,5,8,10,13,15,17-heptasilaspiro[9.9]nonadecane is sourced from PubChem (CID 161140203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).