lithium;magnesium;ethyl 5-trimethylsilyl-3H-furan-3-ide-2-carboxylate;dichloride

C10H15Cl2LiMgO3Si — CID 134834622

IUPAClithium;magnesium;ethyl 5-trimethylsilyl-3H-furan-3-ide-2-carboxylate;dichloride
SMILESCCOC(=O)c1[c-]cc([Si](C)(C)C)o1.[Cl-].[Cl-].[Li+].[Mg+2]
InChIInChI=1S/C10H15O3Si.2ClH.Li.Mg/c1-5-12-10(11)8-6-7-9(13-8)14(2,3)4;;;;/h7H,5H2,1-4H3;2*1H;;/q-1;;;+1;+2/p-2
InChIKeyPIZOSNUAUTYBTP-UHFFFAOYSA-L
MW313.47 g/mol
LogP-7.57
Rot. Bonds3

About lithium;magnesium;ethyl 5-trimethylsilyl-3H-furan-3-ide-2-carboxylate;dichloride

lithium;magnesium;ethyl 5-trimethylsilyl-3H-furan-3-ide-2-carboxylate;dichloride (PubChem CID 134834622) has the molecular formula C10H15Cl2LiMgO3Si and a molecular weight of 313.47 g/mol. Its IUPAC name is lithium;magnesium;ethyl 5-trimethylsilyl-3H-furan-3-ide-2-carboxylate;dichloride.

Molecular Properties

Compound Namelithium;magnesium;ethyl 5-trimethylsilyl-3H-furan-3-ide-2-carboxylate;dichloride
PubChem CID134834622
Molecular FormulaC10H15Cl2LiMgO3Si
Molecular Weight313.47 g/mol
Exact Mass312.02
IUPAC Namelithium;magnesium;ethyl 5-trimethylsilyl-3H-furan-3-ide-2-carboxylate;dichloride
SMILESCCOC(=O)c1[c-]cc([Si](C)(C)C)o1.[Cl-].[Cl-].[Li+].[Mg+2]
InChIInChI=1S/C10H15O3Si.2ClH.Li.Mg/c1-5-12-10(11)8-6-7-9(13-8)14(2,3)4;;;;/h7H,5H2,1-4H3;2*1H;;/q-1;;;+1;+2/p-2
InChIKeyPIZOSNUAUTYBTP-UHFFFAOYSA-L
XLogP-7.57
TPSA39.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.47
LogP ≤ 5-7.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Launch Full Analysis

Related Compounds

lithium;magnesium;diethyl 3H-furan-3-ide-2,5-dicarboxylate;dichloride
CID 134834542
5-methylene-4-(2-(trimethylsilyl)ethoxy)furan-2(5H)-one
CID 154731546
4-(trimethylsilylmethoxy)-2H-furan-5-one
CID 17908853
4-(3-trimethylsilylpropoxy)-2H-furan-5-one
CID 153766302

Frequently Asked Questions

What is the IUPAC name of lithium;magnesium;ethyl 5-trimethylsilyl-3H-furan-3-ide-2-carboxylate;dichloride?
The IUPAC name of lithium;magnesium;ethyl 5-trimethylsilyl-3H-furan-3-ide-2-carboxylate;dichloride (CID 134834622) is lithium;magnesium;ethyl 5-trimethylsilyl-3H-furan-3-ide-2-carboxylate;dichloride.
What is the SMILES notation for lithium;magnesium;ethyl 5-trimethylsilyl-3H-furan-3-ide-2-carboxylate;dichloride?
The canonical SMILES for lithium;magnesium;ethyl 5-trimethylsilyl-3H-furan-3-ide-2-carboxylate;dichloride is CCOC(=O)c1[c-]cc([Si](C)(C)C)o1.[Cl-].[Cl-].[Li+].[Mg+2].
What is the InChIKey of lithium;magnesium;ethyl 5-trimethylsilyl-3H-furan-3-ide-2-carboxylate;dichloride?
The InChIKey is PIZOSNUAUTYBTP-UHFFFAOYSA-L. The full InChI is InChI=1S/C10H15O3Si.2ClH.Li.Mg/c1-5-12-10(11)8-6-7-9(13-8)14(2,3)4;;;;/h7H,5H2,1-4H3;2*1H;;/q-1;;;+1;+2/p-2.
What are the key properties of lithium;magnesium;ethyl 5-trimethylsilyl-3H-furan-3-ide-2-carboxylate;dichloride?
lithium;magnesium;ethyl 5-trimethylsilyl-3H-furan-3-ide-2-carboxylate;dichloride has a molecular weight of 313.47 g/mol, XLogP of -7.57, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;magnesium;ethyl 5-trimethylsilyl-3H-furan-3-ide-2-carboxylate;dichloride is sourced from PubChem (CID 134834622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).