cyclopenta-1,3-diene;formaldehyde;tungsten

C7H9O2W- — CID 88762361

IUPACcyclopenta-1,3-diene;formaldehyde;tungsten
SMILESC=O.C=O.[C-]1=CC=CC1.[W]
InChIInChI=1S/C5H5.2CH2O.W/c1-2-4-5-3-1;2*1-2;/h1-3H,4H2;2*1H2;/q-1;;;
InChIKeyYDYBRDDUPLXEMZ-UHFFFAOYSA-N
MW308.99 g/mol
LogP0.93
Rot. Bonds

About cyclopenta-1,3-diene;formaldehyde;tungsten

cyclopenta-1,3-diene;formaldehyde;tungsten (PubChem CID 88762361) has the molecular formula C7H9O2W- and a molecular weight of 308.99 g/mol. Its IUPAC name is cyclopenta-1,3-diene;formaldehyde;tungsten.

Molecular Properties

Compound Namecyclopenta-1,3-diene;formaldehyde;tungsten
PubChem CID88762361
Molecular FormulaC7H9O2W-
Molecular Weight308.99 g/mol
Exact Mass309.01
IUPAC Namecyclopenta-1,3-diene;formaldehyde;tungsten
SMILESC=O.C=O.[C-]1=CC=CC1.[W]
InChIInChI=1S/C5H5.2CH2O.W/c1-2-4-5-3-1;2*1-2;/h1-3H,4H2;2*1H2;/q-1;;;
InChIKeyYDYBRDDUPLXEMZ-UHFFFAOYSA-N
XLogP0.93
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.99
LogP ≤ 50.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 cyclopenta-1,3-diene;formaldehyde;tungsten?
The IUPAC name of cyclopenta-1,3-diene;formaldehyde;tungsten (CID 88762361) is cyclopenta-1,3-diene;formaldehyde;tungsten.
What is the SMILES notation for cyclopenta-1,3-diene;formaldehyde;tungsten?
The canonical SMILES for cyclopenta-1,3-diene;formaldehyde;tungsten is C=O.C=O.[C-]1=CC=CC1.[W].
What is the InChIKey of cyclopenta-1,3-diene;formaldehyde;tungsten?
The InChIKey is YDYBRDDUPLXEMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5.2CH2O.W/c1-2-4-5-3-1;2*1-2;/h1-3H,4H2;2*1H2;/q-1;;;.
What are the key properties of cyclopenta-1,3-diene;formaldehyde;tungsten?
cyclopenta-1,3-diene;formaldehyde;tungsten has a molecular weight of 308.99 g/mol, XLogP of 0.93, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopenta-1,3-diene;formaldehyde;tungsten is sourced from PubChem (CID 88762361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).