CID 58672213

C12H32O8Si5 — CID 58672213

IUPAC—
SMILESCO[Si](CCCOCCC[SiH]1O[Si](C)O[SiH](C)O[Si](C)O1)(OC)OC
InChIInChI=1S/C12H32O8Si5/c1-13-25(14-2,15-3)12-8-10-16-9-7-11-24-19-22(5)17-21(4)18-23(6)20-24/h21,24H,7-12H2,1-6H3
InChIKeyYHBPXDWYRWRUHQ-UHFFFAOYSA-N
MW444.81 g/mol
LogP1.05
Rot. Bonds11

About CID 58672213

CID 58672213 (PubChem CID 58672213) has the molecular formula C12H32O8Si5 and a molecular weight of 444.81 g/mol.

Molecular Properties

Compound NameCID 58672213
PubChem CID58672213
Molecular FormulaC12H32O8Si5
Molecular Weight444.81 g/mol
Exact Mass444.09
IUPAC Name—
SMILESCO[Si](CCCOCCC[SiH]1O[Si](C)O[SiH](C)O[Si](C)O1)(OC)OC
InChIInChI=1S/C12H32O8Si5/c1-13-25(14-2,15-3)12-8-10-16-9-7-11-24-19-22(5)17-21(4)18-23(6)20-24/h21,24H,7-12H2,1-6H3
InChIKeyYHBPXDWYRWRUHQ-UHFFFAOYSA-N
XLogP1.05
TPSA73.84 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds11
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500444.81
LogP ≤ 51.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Related Compounds

3-(2-trimethoxysilylethoxy)-N,N-bis(trimethylsilyl)propan-1-amine
CID 90355331
3-(fluoromethoxy)propyl-trimethoxysilane
CID 58238485
3-(3-dimethoxysilylpropoxy)propyl-trimethoxysilane
CID 157097284
trimethoxy-[3-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-octadecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propyl]silane
CID 155614579
3-(3-trimethoxysilylpropoxy)propanal
CID 174937943
trimethoxy-[11-(2-methoxyethoxy)undecyl]silane
CID 88574364
5-[2,2-bis(ethoxymethyl)-3-(5-trimethoxysilylpentoxy)propoxy]pentyl-trimethoxysilane;5-[2-(ethoxymethyl)-2-[[2-(ethoxymethyl)-3-(5-trimethoxysilylpentoxy)-2-(5-trimethoxysilylpentoxymethyl)propoxy]methyl]-3-(5-trimethoxysilylpentoxy)propoxy]pentyl-trimethoxysilane;3-[2-(ethoxymethyl)-2-[[2-(ethoxymethyl)-3-(3-trimethoxysilylpropoxy)-2-(3-trimethoxysilylpropoxymethyl)propoxy]methyl]-3-(3-trimethoxysilylpropoxy)propoxy]propyl-trimethoxysilane;5-[2-(ethoxymethyl)-3-(5-trimethoxysilylpentoxy)-2-[[3-(5-trimethoxysilylpentoxy)-2,2-bis(5-trimethoxysilylpentoxymethyl)propoxy]methyl]propoxy]pentyl-trimethoxysilane;3-[2-(ethoxymethyl)-3-(3-trimethoxysilylpropoxy)-2-[[3-(3-trimethoxysilylpropoxy)-2,2-bis(3-trimethoxysilylpropoxymethyl)propoxy]methyl]propoxy]propyl-trimethoxysilane
CID 158154375
3-(3-fluoropropoxy)propyl-trimethoxysilane;fluoro(trimethoxy)methane
CID 90729153
3-(2-fluoroethoxy)propyl-trimethoxysilane;fluoro(trimethoxy)methane
CID 91274401
3-ethoxypropyl-tris[3-[tris(3-trimethoxysilylpropyl)silyl]propyl]silane
CID 157122968
N,N-bis[2-(3-trimethoxysilylpropoxy)ethyl]propan-1-amine;N-(2-propoxyethyl)-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine;N-propyl-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propan-1-amine
CID 162116459
methoxy-[3-[2-(methoxymethoxy)ethoxy]propyl]-dimethylsilane
CID 153300694

Frequently Asked Questions

What is the IUPAC name of CID 58672213?
The IUPAC name of CID 58672213 (CID 58672213) is not available.
What is the SMILES notation for CID 58672213?
The canonical SMILES for CID 58672213 is CO[Si](CCCOCCC[SiH]1O[Si](C)O[SiH](C)O[Si](C)O1)(OC)OC.
What is the InChIKey of CID 58672213?
The InChIKey is YHBPXDWYRWRUHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H32O8Si5/c1-13-25(14-2,15-3)12-8-10-16-9-7-11-24-19-22(5)17-21(4)18-23(6)20-24/h21,24H,7-12H2,1-6H3.
What are the key properties of CID 58672213?
CID 58672213 has a molecular weight of 444.81 g/mol, XLogP of 1.05, 11 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for CID 58672213 is sourced from PubChem (CID 58672213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).