hydroxymethanone;tungsten

C6H6O12W-6 — CID 141151866

IUPAChydroxymethanone;tungsten
SMILESO=[C-]O.O=[C-]O.O=[C-]O.O=[C-]O.O=[C-]O.O=[C-]O.[W]
InChIInChI=1S/6CHO2.W/c6*2-1-3;/h6*(H,2,3);/q6*-1;
InChIKeyBWKJFDKCVDZFOR-UHFFFAOYSA-N
MW453.94 g/mol
LogP-2.33
Rot. Bonds

About hydroxymethanone;tungsten

hydroxymethanone;tungsten (PubChem CID 141151866) has the molecular formula C6H6O12W-6 and a molecular weight of 453.94 g/mol. Its IUPAC name is hydroxymethanone;tungsten.

Molecular Properties

Compound Namehydroxymethanone;tungsten
PubChem CID141151866
Molecular FormulaC6H6O12W-6
Molecular Weight453.94 g/mol
Exact Mass453.94
IUPAC Namehydroxymethanone;tungsten
SMILESO=[C-]O.O=[C-]O.O=[C-]O.O=[C-]O.O=[C-]O.O=[C-]O.[W]
InChIInChI=1S/6CHO2.W/c6*2-1-3;/h6*(H,2,3);/q6*-1;
InChIKeyBWKJFDKCVDZFOR-UHFFFAOYSA-N
XLogP-2.33
TPSA223.80 Ų
H-Bond Donors6
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500453.94
LogP ≤ 5-2.33
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

hydroxymethanone
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CID 59094876
hydroxymethanone;ruthenium(4+)
CID 172995275
sodium;hydroxymethanone;phosphane
CID 159362533
hydroxymethanone;oxovanadium(2+)
CID 87184679
bismuthane;hydroxymethanone;zinc
CID 174420136
copper(1+);hydroxymethanone;methane
CID 174882093
silver;azane;hydroxymethanone
CID 166682246
disodium;hydroxymethanone;bis(iron(3+))
CID 173448481
CID 162461372
CID 162461372

Frequently Asked Questions

What is the IUPAC name of hydroxymethanone;tungsten?
The IUPAC name of hydroxymethanone;tungsten (CID 141151866) is hydroxymethanone;tungsten.
What is the SMILES notation for hydroxymethanone;tungsten?
The canonical SMILES for hydroxymethanone;tungsten is O=[C-]O.O=[C-]O.O=[C-]O.O=[C-]O.O=[C-]O.O=[C-]O.[W].
What is the InChIKey of hydroxymethanone;tungsten?
The InChIKey is BWKJFDKCVDZFOR-UHFFFAOYSA-N. The full InChI is InChI=1S/6CHO2.W/c6*2-1-3;/h6*(H,2,3);/q6*-1;.
What are the key properties of hydroxymethanone;tungsten?
hydroxymethanone;tungsten has a molecular weight of 453.94 g/mol, XLogP of -2.33, 0 rotatable bonds, 6 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxymethanone;tungsten is sourced from PubChem (CID 141151866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).