hydroxy-dimethyl-(5-trimethoxysilylpentyl)azanium chloride

C10H26ClNO4Si — CID 87380742

IUPAChydroxy-dimethyl-(5-trimethoxysilylpentyl)azanium chloride
SMILESCO[Si](CCCCC[N+](C)(C)O)(OC)OC.[Cl-]
InChIInChI=1S/C10H26NO4Si.ClH/c1-11(2,12)9-7-6-8-10-16(13-3,14-4)15-5;/h12H,6-10H2,1-5H3;1H/q+1;/p-1
InChIKeyHMBXYTKDWBFEPG-UHFFFAOYSA-M
MW287.86 g/mol
LogP-1.50
Rot. Bonds9

About hydroxy-dimethyl-(5-trimethoxysilylpentyl)azanium chloride

hydroxy-dimethyl-(5-trimethoxysilylpentyl)azanium chloride (PubChem CID 87380742) has the molecular formula C10H26ClNO4Si and a molecular weight of 287.86 g/mol. Its IUPAC name is hydroxy-dimethyl-(5-trimethoxysilylpentyl)azanium chloride.

Molecular Properties

Compound Namehydroxy-dimethyl-(5-trimethoxysilylpentyl)azanium chloride
PubChem CID87380742
Molecular FormulaC10H26ClNO4Si
Molecular Weight287.86 g/mol
Exact Mass287.13
IUPAC Namehydroxy-dimethyl-(5-trimethoxysilylpentyl)azanium chloride
SMILESCO[Si](CCCCC[N+](C)(C)O)(OC)OC.[Cl-]
InChIInChI=1S/C10H26NO4Si.ClH/c1-11(2,12)9-7-6-8-10-16(13-3,14-4)15-5;/h12H,6-10H2,1-5H3;1H/q+1;/p-1
InChIKeyHMBXYTKDWBFEPG-UHFFFAOYSA-M
XLogP-1.50
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.86
LogP ≤ 5-1.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

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Related Compounds

trimethoxy(6-trimethoxysilylhexyl)silane
CID 158013726
dimethyl-pentadecyl-(6-trimethoxysilylhexyl)azanium chloride
CID 88730499
dimethyl-tetradecyl-(4-trimethoxysilylbutyl)azanium chloride
CID 88731013
hydroxy-dimethyl-tetracosylazanium chloride
CID 158718920
31-trimethoxysilylhentriacontan-1-ol
CID 87684107
6-trimethoxysilylhexan-1-ol
CID 22497813
16-trimethoxysilylhexadecan-1-ol
CID 87683754
26-trimethoxysilylhexacosan-1-ol
CID 87686281
methanolate;bis(trimethyl(3-trimethoxysilylpropyl)azanium);chloride
CID 156778994
ethyl-hexadecyl-methyl-(3-trimethoxysilylpropyl)azanium chloride
CID 141071591
icosyl-dimethyl-(3-trimethoxysilylpropyl)azanium iodide
CID 164521067
hydroxy-dimethyl-(5-trimethoxysilylpentan-2-yl)azanium chloride
CID 87380739

Frequently Asked Questions

What is the IUPAC name of hydroxy-dimethyl-(5-trimethoxysilylpentyl)azanium chloride?
The IUPAC name of hydroxy-dimethyl-(5-trimethoxysilylpentyl)azanium chloride (CID 87380742) is hydroxy-dimethyl-(5-trimethoxysilylpentyl)azanium chloride.
What is the SMILES notation for hydroxy-dimethyl-(5-trimethoxysilylpentyl)azanium chloride?
The canonical SMILES for hydroxy-dimethyl-(5-trimethoxysilylpentyl)azanium chloride is CO[Si](CCCCC[N+](C)(C)O)(OC)OC.[Cl-].
What is the InChIKey of hydroxy-dimethyl-(5-trimethoxysilylpentyl)azanium chloride?
The InChIKey is HMBXYTKDWBFEPG-UHFFFAOYSA-M. The full InChI is InChI=1S/C10H26NO4Si.ClH/c1-11(2,12)9-7-6-8-10-16(13-3,14-4)15-5;/h12H,6-10H2,1-5H3;1H/q+1;/p-1.
What are the key properties of hydroxy-dimethyl-(5-trimethoxysilylpentyl)azanium chloride?
hydroxy-dimethyl-(5-trimethoxysilylpentyl)azanium chloride has a molecular weight of 287.86 g/mol, XLogP of -1.50, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy-dimethyl-(5-trimethoxysilylpentyl)azanium chloride is sourced from PubChem (CID 87380742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).