dilithium;carbanide;trichloro(ethyl)silane;bis(triethoxy(ethyl)silane);bromide

C19H48BrCl3Li2O6Si3 — CID 160902818

IUPACdilithium;carbanide;trichloro(ethyl)silane;bis(triethoxy(ethyl)silane);bromide
SMILESCCO[Si](CC)(OCC)OCC.CCO[Si](CC)(OCC)OCC.CC[Si](Cl)(Cl)Cl.[Br-].[CH3-].[Li+].[Li+]
InChIInChI=1S/2C8H20O3Si.C2H5Cl3Si.CH3.BrH.2Li/c2*1-5-9-12(8-4,10-6-2)11-7-3;1-2-6(3,4)5;;;;/h2*5-8H2,1-4H3;2H2,1H3;1H3;1H;;/q;;;-1;;2*+1/p-1
InChIKeyLTQUHDLFKOMUPH-UHFFFAOYSA-M
MW656.99 g/mol
LogP-1.77
Rot. Bonds15

About dilithium;carbanide;trichloro(ethyl)silane;bis(triethoxy(ethyl)silane);bromide

dilithium;carbanide;trichloro(ethyl)silane;bis(triethoxy(ethyl)silane);bromide (PubChem CID 160902818) has the molecular formula C19H48BrCl3Li2O6Si3 and a molecular weight of 656.99 g/mol. Its IUPAC name is dilithium;carbanide;trichloro(ethyl)silane;bis(triethoxy(ethyl)silane);bromide.

Molecular Properties

Compound Namedilithium;carbanide;trichloro(ethyl)silane;bis(triethoxy(ethyl)silane);bromide
PubChem CID160902818
Molecular FormulaC19H48BrCl3Li2O6Si3
Molecular Weight656.99 g/mol
Exact Mass654.13
IUPAC Namedilithium;carbanide;trichloro(ethyl)silane;bis(triethoxy(ethyl)silane);bromide
SMILESCCO[Si](CC)(OCC)OCC.CCO[Si](CC)(OCC)OCC.CC[Si](Cl)(Cl)Cl.[Br-].[CH3-].[Li+].[Li+]
InChIInChI=1S/2C8H20O3Si.C2H5Cl3Si.CH3.BrH.2Li/c2*1-5-9-12(8-4,10-6-2)11-7-3;1-2-6(3,4)5;;;;/h2*5-8H2,1-4H3;2H2,1H3;1H3;1H;;/q;;;-1;;2*+1/p-1
InChIKeyLTQUHDLFKOMUPH-UHFFFAOYSA-M
XLogP-1.77
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds15
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500656.99
LogP ≤ 5-1.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

diethoxy-ethyl-propoxysilane
CID 22211908
ethoxy-ethyl-dipropoxysilane
CID 525754
trichloro(ethyl)silane
CID 8260
ethyl(tripropoxy)silane;triethoxy(propyl)silane
CID 19799420
diethoxy-ethyl-propan-2-yloxysilane
CID 18331965
azane;[bis(disulfanyl)-ethyl-λ4-sulfanyl]-triethoxysilane;triethoxy(ethyl)silane
CID 173219815
1-[diethoxy(ethyl)silyl]oxyethylphosphane
CID 157287140
4-[2-[diethoxy(ethyl)silyl]oxyethyl]benzenesulfonyl chloride
CID 87221820
diphenylphosphane;triethoxy(ethyl)silane
CID 67019736
2-diethylphosphorylethoxy-diethoxy-ethylsilane
CID 154585184
trichloro(ethyl)silane;trichlorosilane
CID 173057745
ethanol;tetrachlorosilane;trichloro(ethoxy)silane;hydrochloride
CID 161444026

Frequently Asked Questions

What is the IUPAC name of dilithium;carbanide;trichloro(ethyl)silane;bis(triethoxy(ethyl)silane);bromide?
The IUPAC name of dilithium;carbanide;trichloro(ethyl)silane;bis(triethoxy(ethyl)silane);bromide (CID 160902818) is dilithium;carbanide;trichloro(ethyl)silane;bis(triethoxy(ethyl)silane);bromide.
What is the SMILES notation for dilithium;carbanide;trichloro(ethyl)silane;bis(triethoxy(ethyl)silane);bromide?
The canonical SMILES for dilithium;carbanide;trichloro(ethyl)silane;bis(triethoxy(ethyl)silane);bromide is CCO[Si](CC)(OCC)OCC.CCO[Si](CC)(OCC)OCC.CC[Si](Cl)(Cl)Cl.[Br-].[CH3-].[Li+].[Li+].
What is the InChIKey of dilithium;carbanide;trichloro(ethyl)silane;bis(triethoxy(ethyl)silane);bromide?
The InChIKey is LTQUHDLFKOMUPH-UHFFFAOYSA-M. The full InChI is InChI=1S/2C8H20O3Si.C2H5Cl3Si.CH3.BrH.2Li/c2*1-5-9-12(8-4,10-6-2)11-7-3;1-2-6(3,4)5;;;;/h2*5-8H2,1-4H3;2H2,1H3;1H3;1H;;/q;;;-1;;2*+1/p-1.
What are the key properties of dilithium;carbanide;trichloro(ethyl)silane;bis(triethoxy(ethyl)silane);bromide?
dilithium;carbanide;trichloro(ethyl)silane;bis(triethoxy(ethyl)silane);bromide has a molecular weight of 656.99 g/mol, XLogP of -1.77, 15 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for dilithium;carbanide;trichloro(ethyl)silane;bis(triethoxy(ethyl)silane);bromide is sourced from PubChem (CID 160902818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).