hydroxy(methyl)silane;3-triethoxysilylpropan-1-amine;bis(3-trimethylsilylpropan-1-amine)

C23H69N3O5Si5 — CID 159301197

IUPAChydroxy(methyl)silane;3-triethoxysilylpropan-1-amine;bis(3-trimethylsilylpropan-1-amine)
SMILESCCO[Si](CCCN)(OCC)OCC.C[SiH2]O.C[SiH2]O.C[Si](C)(C)CCCN.C[Si](C)(C)CCCN
InChIInChI=1S/C9H23NO3Si.2C6H17NSi.2CH6OSi/c1-4-11-14(12-5-2,13-6-3)9-7-8-10;2*1-8(2,3)6-4-5-7;2*1-3-2/h4-10H2,1-3H3;2*4-7H2,1-3H3;2*2H,3H2,1H3
InChIKeyLBIXSCKTPFOBOZ-UHFFFAOYSA-N
MW608.25 g/mol
LogP2.95
Rot. Bonds15

About hydroxy(methyl)silane;3-triethoxysilylpropan-1-amine;bis(3-trimethylsilylpropan-1-amine)

hydroxy(methyl)silane;3-triethoxysilylpropan-1-amine;bis(3-trimethylsilylpropan-1-amine) (PubChem CID 159301197) has the molecular formula C23H69N3O5Si5 and a molecular weight of 608.25 g/mol. Its IUPAC name is hydroxy(methyl)silane;3-triethoxysilylpropan-1-amine;bis(3-trimethylsilylpropan-1-amine).

Molecular Properties

Compound Namehydroxy(methyl)silane;3-triethoxysilylpropan-1-amine;bis(3-trimethylsilylpropan-1-amine)
PubChem CID159301197
Molecular FormulaC23H69N3O5Si5
Molecular Weight608.25 g/mol
Exact Mass607.41
IUPAC Namehydroxy(methyl)silane;3-triethoxysilylpropan-1-amine;bis(3-trimethylsilylpropan-1-amine)
SMILESCCO[Si](CCCN)(OCC)OCC.C[SiH2]O.C[SiH2]O.C[Si](C)(C)CCCN.C[Si](C)(C)CCCN
InChIInChI=1S/C9H23NO3Si.2C6H17NSi.2CH6OSi/c1-4-11-14(12-5-2,13-6-3)9-7-8-10;2*1-8(2,3)6-4-5-7;2*1-3-2/h4-10H2,1-3H3;2*4-7H2,1-3H3;2*2H,3H2,1H3
InChIKeyLBIXSCKTPFOBOZ-UHFFFAOYSA-N
XLogP2.95
TPSA146.21 Ų
H-Bond Donors5
H-Bond Acceptors8
Rotatable Bonds15
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500608.25
LogP ≤ 52.95
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

Analyze hydroxy(methyl)silane;3-triethoxysilylpropan-1-amine;bis(3-trimethylsilylpropan-1-amine) with MolForge

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Related Compounds

sulfuric acid;3-triethoxysilylpropan-1-amine
CID 172732865
36-triethoxysilylhexatriacontan-1-amine
CID 87683625
ethyl carbamate;3-triethoxysilylpropan-1-amine
CID 90205560
azido(trimethyl)silane;3-triethoxysilylpropan-1-amine
CID 158510723
3-[[3-aminopropyl-[3-aminopropyl(diethoxy)silyl]oxy-ethoxysilyl]oxy-diethoxysilyl]propan-1-amine
CID 143956342
12-triethoxysilyldodecan-1-amine;hydrochloride
CID 175579282
ethanol;bis(3-[ethoxy(dihydroxy)silyl]propan-1-amine);methane;bis(3-triethoxysilylpropan-1-amine)
CID 167608447
ethyl(trimethyl)silane;3-trimethylsilylpropan-1-amine
CID 90988391
3-[diethoxy(methoxy)silyl]propan-1-amine;3-[ethoxy(dimethoxy)silyl]propan-1-amine;3-trimethoxysilylpropan-1-amine
CID 159243688
3-(3-aminopropyl-ethoxy-methylsilyl)propan-1-amine
CID 87400628
3-(3-triethoxysilylpropoxy)propan-1-amine
CID 54154158
[3-aminopropyl(diethoxy)silyl] triethyl silicate
CID 22065708

Frequently Asked Questions

What is the IUPAC name of hydroxy(methyl)silane;3-triethoxysilylpropan-1-amine;bis(3-trimethylsilylpropan-1-amine)?
The IUPAC name of hydroxy(methyl)silane;3-triethoxysilylpropan-1-amine;bis(3-trimethylsilylpropan-1-amine) (CID 159301197) is hydroxy(methyl)silane;3-triethoxysilylpropan-1-amine;bis(3-trimethylsilylpropan-1-amine).
What is the SMILES notation for hydroxy(methyl)silane;3-triethoxysilylpropan-1-amine;bis(3-trimethylsilylpropan-1-amine)?
The canonical SMILES for hydroxy(methyl)silane;3-triethoxysilylpropan-1-amine;bis(3-trimethylsilylpropan-1-amine) is CCO[Si](CCCN)(OCC)OCC.C[SiH2]O.C[SiH2]O.C[Si](C)(C)CCCN.C[Si](C)(C)CCCN.
What is the InChIKey of hydroxy(methyl)silane;3-triethoxysilylpropan-1-amine;bis(3-trimethylsilylpropan-1-amine)?
The InChIKey is LBIXSCKTPFOBOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H23NO3Si.2C6H17NSi.2CH6OSi/c1-4-11-14(12-5-2,13-6-3)9-7-8-10;2*1-8(2,3)6-4-5-7;2*1-3-2/h4-10H2,1-3H3;2*4-7H2,1-3H3;2*2H,3H2,1H3.
What are the key properties of hydroxy(methyl)silane;3-triethoxysilylpropan-1-amine;bis(3-trimethylsilylpropan-1-amine)?
hydroxy(methyl)silane;3-triethoxysilylpropan-1-amine;bis(3-trimethylsilylpropan-1-amine) has a molecular weight of 608.25 g/mol, XLogP of 2.95, 15 rotatable bonds, 5 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy(methyl)silane;3-triethoxysilylpropan-1-amine;bis(3-trimethylsilylpropan-1-amine) is sourced from PubChem (CID 159301197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).