cyclohexane;propan-2-one;tungsten(2+)

C9H16OW — CID 58361870

IUPACcyclohexane;propan-2-one;tungsten(2+)
SMILES[CH-]1CCCCC1.[CH2-]C(C)=O.[W+2]
InChIInChI=1S/C6H11.C3H5O.W/c1-2-4-6-5-3-1;1-3(2)4;/h1H,2-6H2;1H2,2H3;/q2*-1;+2
InChIKeyYRLSCEFEEJCWEK-UHFFFAOYSA-N
MW324.07 g/mol
LogP2.56
Rot. Bonds

About cyclohexane;propan-2-one;tungsten(2+)

cyclohexane;propan-2-one;tungsten(2+) (PubChem CID 58361870) has the molecular formula C9H16OW and a molecular weight of 324.07 g/mol. Its IUPAC name is cyclohexane;propan-2-one;tungsten(2+).

Molecular Properties

Compound Namecyclohexane;propan-2-one;tungsten(2+)
PubChem CID58361870
Molecular FormulaC9H16OW
Molecular Weight324.07 g/mol
Exact Mass324.07
IUPAC Namecyclohexane;propan-2-one;tungsten(2+)
SMILES[CH-]1CCCCC1.[CH2-]C(C)=O.[W+2]
InChIInChI=1S/C6H11.C3H5O.W/c1-2-4-6-5-3-1;1-3(2)4;/h1H,2-6H2;1H2,2H3;/q2*-1;+2
InChIKeyYRLSCEFEEJCWEK-UHFFFAOYSA-N
XLogP2.56
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.07
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of cyclohexane;propan-2-one;tungsten(2+)?
The IUPAC name of cyclohexane;propan-2-one;tungsten(2+) (CID 58361870) is cyclohexane;propan-2-one;tungsten(2+).
What is the SMILES notation for cyclohexane;propan-2-one;tungsten(2+)?
The canonical SMILES for cyclohexane;propan-2-one;tungsten(2+) is [CH-]1CCCCC1.[CH2-]C(C)=O.[W+2].
What is the InChIKey of cyclohexane;propan-2-one;tungsten(2+)?
The InChIKey is YRLSCEFEEJCWEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11.C3H5O.W/c1-2-4-6-5-3-1;1-3(2)4;/h1H,2-6H2;1H2,2H3;/q2*-1;+2.
What are the key properties of cyclohexane;propan-2-one;tungsten(2+)?
cyclohexane;propan-2-one;tungsten(2+) has a molecular weight of 324.07 g/mol, XLogP of 2.56, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexane;propan-2-one;tungsten(2+) is sourced from PubChem (CID 58361870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).