carbon monoxide;hydride;1-methylcyclopenta-1,3-diene;tungsten(2+)

C9H8O3W — CID 134694826

IUPACcarbon monoxide;hydride;1-methylcyclopenta-1,3-diene;tungsten(2+)
SMILESCc1ccc[cH-]1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[H-].[W+2]
InChIInChI=1S/C6H7.3CO.W.H/c1-6-4-2-3-5-6;3*1-2;;/h2-5H,1H3;;;;;/q-1;;;;+2;-1
InChIKeyYHDWHCGBJIUSDW-UHFFFAOYSA-N
MW348.00 g/mol
LogP1.71
Rot. Bonds

About carbon monoxide;hydride;1-methylcyclopenta-1,3-diene;tungsten(2+)

carbon monoxide;hydride;1-methylcyclopenta-1,3-diene;tungsten(2+) (PubChem CID 134694826) has the molecular formula C9H8O3W and a molecular weight of 348.00 g/mol. Its IUPAC name is carbon monoxide;hydride;1-methylcyclopenta-1,3-diene;tungsten(2+).

Molecular Properties

Compound Namecarbon monoxide;hydride;1-methylcyclopenta-1,3-diene;tungsten(2+)
PubChem CID134694826
Molecular FormulaC9H8O3W
Molecular Weight348.00 g/mol
Exact Mass348.00
IUPAC Namecarbon monoxide;hydride;1-methylcyclopenta-1,3-diene;tungsten(2+)
SMILESCc1ccc[cH-]1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[H-].[W+2]
InChIInChI=1S/C6H7.3CO.W.H/c1-6-4-2-3-5-6;3*1-2;;/h2-5H,1H3;;;;;/q-1;;;;+2;-1
InChIKeyYHDWHCGBJIUSDW-UHFFFAOYSA-N
XLogP1.71
TPSA59.70 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.00
LogP ≤ 51.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

chromium(2+);bis(1-methylcyclopenta-1,3-diene)
CID 160665189
bis(1-methylcyclopenta-1,3-diene);zirconium(2+)
CID 131719615
cobalt;tris(cyclopenta-1,3-diene);1-methylcyclopenta-1,3-diene
CID 158473034
azanide;carbon monoxide;cyclopenta-1,3-diene;iron;iron(2+);manganese(3+);bis(1-methylcyclopenta-1,3-diene);nitroxyl anion;tetraphenylboranuide
CID 139264509
carbanide;bis(cyclopenta-1,3-diene);1-ethylcyclopenta-1,3-diene;bis(iron(4+));methane;1-methylcyclopenta-1,3-diene
CID 158519657
bis(1-ethylcyclopenta-1,3-diene);titanium(2+)
CID 172701358
carbon monoxide;tungsten;1,2-xylene
CID 11987132
cyclopenta-1,3-dien-1-ylazanide
CID 15802369
bis(1-butylcyclopenta-1,3-diene);titanium(2+)
CID 159034563
chromium(2+);bis(cyclopenta-1,3-dien-1-amine)
CID 175973663
bis(1-iodocyclopenta-1,3-diene);ruthenium(2+)
CID 158276340
1-butylcyclopenta-1,3-diene;hafnium;dichloride
CID 158111562

Frequently Asked Questions

What is the IUPAC name of carbon monoxide;hydride;1-methylcyclopenta-1,3-diene;tungsten(2+)?
The IUPAC name of carbon monoxide;hydride;1-methylcyclopenta-1,3-diene;tungsten(2+) (CID 134694826) is carbon monoxide;hydride;1-methylcyclopenta-1,3-diene;tungsten(2+).
What is the SMILES notation for carbon monoxide;hydride;1-methylcyclopenta-1,3-diene;tungsten(2+)?
The canonical SMILES for carbon monoxide;hydride;1-methylcyclopenta-1,3-diene;tungsten(2+) is Cc1ccc[cH-]1.[C-]#[O+].[C-]#[O+].[C-]#[O+].[H-].[W+2].
What is the InChIKey of carbon monoxide;hydride;1-methylcyclopenta-1,3-diene;tungsten(2+)?
The InChIKey is YHDWHCGBJIUSDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7.3CO.W.H/c1-6-4-2-3-5-6;3*1-2;;/h2-5H,1H3;;;;;/q-1;;;;+2;-1.
What are the key properties of carbon monoxide;hydride;1-methylcyclopenta-1,3-diene;tungsten(2+)?
carbon monoxide;hydride;1-methylcyclopenta-1,3-diene;tungsten(2+) has a molecular weight of 348.00 g/mol, XLogP of 1.71, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for carbon monoxide;hydride;1-methylcyclopenta-1,3-diene;tungsten(2+) is sourced from PubChem (CID 134694826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).