tetramethylazanium;vanadium;hexaformate

C10H18NO12V-5 — CID 157422387

IUPACtetramethylazanium;vanadium;hexaformate
SMILESC[N+](C)(C)C.O=C[O-].O=C[O-].O=C[O-].O=C[O-].O=C[O-].O=C[O-].[V]
InChIInChI=1S/C4H12N.6CH2O2.V/c1-5(2,3)4;6*2-1-3;/h1-4H3;6*1H,(H,2,3);/q+1;;;;;;;/p-6
InChIKeyWAENPPJFXACHRD-UHFFFAOYSA-H
MW395.19 g/mol
LogP-9.48
Rot. Bonds

About tetramethylazanium;vanadium;hexaformate

tetramethylazanium;vanadium;hexaformate (PubChem CID 157422387) has the molecular formula C10H18NO12V-5 and a molecular weight of 395.19 g/mol. Its IUPAC name is tetramethylazanium;vanadium;hexaformate.

Molecular Properties

Compound Nametetramethylazanium;vanadium;hexaformate
PubChem CID157422387
Molecular FormulaC10H18NO12V-5
Molecular Weight395.19 g/mol
Exact Mass395.03
IUPAC Nametetramethylazanium;vanadium;hexaformate
SMILESC[N+](C)(C)C.O=C[O-].O=C[O-].O=C[O-].O=C[O-].O=C[O-].O=C[O-].[V]
InChIInChI=1S/C4H12N.6CH2O2.V/c1-5(2,3)4;6*2-1-3;/h1-4H3;6*1H,(H,2,3);/q+1;;;;;;;/p-6
InChIKeyWAENPPJFXACHRD-UHFFFAOYSA-H
XLogP-9.48
TPSA240.78 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500395.19
LogP ≤ 5-9.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

Computed Properties (RDKit)

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

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Related Compounds

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trimethylsulfanium formate
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Frequently Asked Questions

What is the IUPAC name of tetramethylazanium;vanadium;hexaformate?
The IUPAC name of tetramethylazanium;vanadium;hexaformate (CID 157422387) is tetramethylazanium;vanadium;hexaformate.
What is the SMILES notation for tetramethylazanium;vanadium;hexaformate?
The canonical SMILES for tetramethylazanium;vanadium;hexaformate is C[N+](C)(C)C.O=C[O-].O=C[O-].O=C[O-].O=C[O-].O=C[O-].O=C[O-].[V].
What is the InChIKey of tetramethylazanium;vanadium;hexaformate?
The InChIKey is WAENPPJFXACHRD-UHFFFAOYSA-H. The full InChI is InChI=1S/C4H12N.6CH2O2.V/c1-5(2,3)4;6*2-1-3;/h1-4H3;6*1H,(H,2,3);/q+1;;;;;;;/p-6.
What are the key properties of tetramethylazanium;vanadium;hexaformate?
tetramethylazanium;vanadium;hexaformate has a molecular weight of 395.19 g/mol, XLogP of -9.48, 0 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for tetramethylazanium;vanadium;hexaformate is sourced from PubChem (CID 157422387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).