trimethyl(1-trimethoxysilylpropyl)azanium hydroxide

C9H25NO4Si — CID 87514002

IUPACtrimethyl(1-trimethoxysilylpropyl)azanium hydroxide
SMILESCCC([N+](C)(C)C)[Si](OC)(OC)OC.[OH-]
InChIInChI=1S/C9H24NO3Si.H2O/c1-8-9(10(2,3)4)14(11-5,12-6)13-7;/h9H,8H2,1-7H3;1H2/q+1;/p-1
InChIKeyBDHRGLUBUQKYCJ-UHFFFAOYSA-M
MW239.39 g/mol
LogP0.71
Rot. Bonds6

About trimethyl(1-trimethoxysilylpropyl)azanium hydroxide

trimethyl(1-trimethoxysilylpropyl)azanium hydroxide (PubChem CID 87514002) has the molecular formula C9H25NO4Si and a molecular weight of 239.39 g/mol. Its IUPAC name is trimethyl(1-trimethoxysilylpropyl)azanium hydroxide.

Molecular Properties

Compound Nametrimethyl(1-trimethoxysilylpropyl)azanium hydroxide
PubChem CID87514002
Molecular FormulaC9H25NO4Si
Molecular Weight239.39 g/mol
Exact Mass239.16
IUPAC Nametrimethyl(1-trimethoxysilylpropyl)azanium hydroxide
SMILESCCC([N+](C)(C)C)[Si](OC)(OC)OC.[OH-]
InChIInChI=1S/C9H24NO3Si.H2O/c1-8-9(10(2,3)4)14(11-5,12-6)13-7;/h9H,8H2,1-7H3;1H2/q+1;/p-1
InChIKeyBDHRGLUBUQKYCJ-UHFFFAOYSA-M
XLogP0.71
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.39
LogP ≤ 50.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

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Related Compounds

1-Propanamine, N,N-dimethyl-3-(trimethoxysilyl)-
CID 75668
1-Propanamine, N,N-diethyl-3-(trimethoxysilyl)-
CID 170458
Trimethoxysilylpropyl-N,N,N-trimethylammonium chloride
CID 94462
Bis(3-(methylamino)propyl)trimethoxysilane
CID 5066074
Triethoxysilylpropyltrimethylammonium chloride
CID 23002981
(3-N,N-Dimethylaminopropyl)methyldimethoxysilane
CID 12495938
N,N,N-trimethyl-3-(trimethoxysilyl)propan-1-aminium
CID 94463
N,N-Dimethyl-3-(triethoxysilyl)propan-1-amine
CID 13574941
N,N-Diethyl-3-(triethoxysilyl)propan-1-amine
CID 15001037
1-Propanamine, N,N-dimethyl-3-(trimethoxysilyl)-, hydrochloride (1:1)
CID 105544
N,N-diethyl-aminopropyl-methyldimethoxysilane
CID 12655870
N-dimethylaminopropyltriethoxysilane
CID 22491494

Frequently Asked Questions

What is the IUPAC name of trimethyl(1-trimethoxysilylpropyl)azanium hydroxide?
The IUPAC name of trimethyl(1-trimethoxysilylpropyl)azanium hydroxide (CID 87514002) is trimethyl(1-trimethoxysilylpropyl)azanium hydroxide.
What is the SMILES notation for trimethyl(1-trimethoxysilylpropyl)azanium hydroxide?
The canonical SMILES for trimethyl(1-trimethoxysilylpropyl)azanium hydroxide is CCC([N+](C)(C)C)[Si](OC)(OC)OC.[OH-].
What is the InChIKey of trimethyl(1-trimethoxysilylpropyl)azanium hydroxide?
The InChIKey is BDHRGLUBUQKYCJ-UHFFFAOYSA-M. The full InChI is InChI=1S/C9H24NO3Si.H2O/c1-8-9(10(2,3)4)14(11-5,12-6)13-7;/h9H,8H2,1-7H3;1H2/q+1;/p-1.
What are the key properties of trimethyl(1-trimethoxysilylpropyl)azanium hydroxide?
trimethyl(1-trimethoxysilylpropyl)azanium hydroxide has a molecular weight of 239.39 g/mol, XLogP of 0.71, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl(1-trimethoxysilylpropyl)azanium hydroxide is sourced from PubChem (CID 87514002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).