cyclododecyloxy-(oxan-2-yl)-bis(trimethoxysilyl)silane

C23H50O8Si3 — CID 69027670

IUPACcyclododecyloxy-(oxan-2-yl)-bis(trimethoxysilyl)silane
SMILESCO[Si](OC)(OC)[Si](OC1CCCCCCCCCCC1)(C1CCCCO1)[Si](OC)(OC)OC
InChIInChI=1S/C23H50O8Si3/c1-24-33(25-2,26-3)32(23-20-16-17-21-30-23,34(27-4,28-5)29-6)31-22-18-14-12-10-8-7-9-11-13-15-19-22/h22-23H,7-21H2,1-6H3
InChIKeyDYPCJRZPMNVLPK-UHFFFAOYSA-N
MW538.90 g/mol
LogP4.64
Rot. Bonds11

About cyclododecyloxy-(oxan-2-yl)-bis(trimethoxysilyl)silane

cyclododecyloxy-(oxan-2-yl)-bis(trimethoxysilyl)silane (PubChem CID 69027670) has the molecular formula C23H50O8Si3 and a molecular weight of 538.90 g/mol. Its IUPAC name is cyclododecyloxy-(oxan-2-yl)-bis(trimethoxysilyl)silane.

Molecular Properties

Compound Namecyclododecyloxy-(oxan-2-yl)-bis(trimethoxysilyl)silane
PubChem CID69027670
Molecular FormulaC23H50O8Si3
Molecular Weight538.90 g/mol
Exact Mass538.28
IUPAC Namecyclododecyloxy-(oxan-2-yl)-bis(trimethoxysilyl)silane
SMILESCO[Si](OC)(OC)[Si](OC1CCCCCCCCCCC1)(C1CCCCO1)[Si](OC)(OC)OC
InChIInChI=1S/C23H50O8Si3/c1-24-33(25-2,26-3)32(23-20-16-17-21-30-23,34(27-4,28-5)29-6)31-22-18-14-12-10-8-7-9-11-13-15-19-22/h22-23H,7-21H2,1-6H3
InChIKeyDYPCJRZPMNVLPK-UHFFFAOYSA-N
XLogP4.64
TPSA73.84 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds11
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500538.90
LogP ≤ 54.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Related Compounds

cyclopentyloxy(trimethyl)silane
CID 554693
methoxycyclohexane;methoxycyclopentane;2-methoxyoxane;2-methoxyoxolane
CID 157095286
dimethoxy-(oxolan-2-yl)-propan-2-ylsilane
CID 140844300
2-methoxyoxepane
CID 24974084
cyclopentyloxy-tris(trimethylsilyl)silane
CID 14640291
cyclohexyloxy-methyl-di(propan-2-yl)silane
CID 19875558
2-cycloheptyloxyoxane
CID 11735764
hexadecyl-methyl-octadecyl-(oxan-2-yl)silane
CID 175378767
methoxycyclooctane
CID 551195
4-[dimethyl(oxan-2-yl)silyl]butane-1,1-diol
CID 175140530
cyclohexyl-(methoxymethyl)-(2-methylpropyl)-(oxolan-2-yl)silane
CID 140844313
trimethyl-[oxan-2-yl(diphenyl)silyl]oxysilane
CID 57469192

Frequently Asked Questions

What is the IUPAC name of cyclododecyloxy-(oxan-2-yl)-bis(trimethoxysilyl)silane?
The IUPAC name of cyclododecyloxy-(oxan-2-yl)-bis(trimethoxysilyl)silane (CID 69027670) is cyclododecyloxy-(oxan-2-yl)-bis(trimethoxysilyl)silane.
What is the SMILES notation for cyclododecyloxy-(oxan-2-yl)-bis(trimethoxysilyl)silane?
The canonical SMILES for cyclododecyloxy-(oxan-2-yl)-bis(trimethoxysilyl)silane is CO[Si](OC)(OC)[Si](OC1CCCCCCCCCCC1)(C1CCCCO1)[Si](OC)(OC)OC.
What is the InChIKey of cyclododecyloxy-(oxan-2-yl)-bis(trimethoxysilyl)silane?
The InChIKey is DYPCJRZPMNVLPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H50O8Si3/c1-24-33(25-2,26-3)32(23-20-16-17-21-30-23,34(27-4,28-5)29-6)31-22-18-14-12-10-8-7-9-11-13-15-19-22/h22-23H,7-21H2,1-6H3.
What are the key properties of cyclododecyloxy-(oxan-2-yl)-bis(trimethoxysilyl)silane?
cyclododecyloxy-(oxan-2-yl)-bis(trimethoxysilyl)silane has a molecular weight of 538.90 g/mol, XLogP of 4.64, 11 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for cyclododecyloxy-(oxan-2-yl)-bis(trimethoxysilyl)silane is sourced from PubChem (CID 69027670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).