but-2-en-2-ylbenzene;tungsten(2+)

C10H10W — CID 20767133

IUPACbut-2-en-2-ylbenzene;tungsten(2+)
SMILESC/[C-]=C(\C)c1[c-]cccc1.[W+2]
InChIInChI=1S/C10H10.W/c1-3-9(2)10-7-5-4-6-8-10;/h4-7H,1-2H3;/q-2;+2
InChIKeyIWBNCWYJNROSEH-UHFFFAOYSA-N
MW314.03 g/mol
LogP2.71
Rot. Bonds1

About but-2-en-2-ylbenzene;tungsten(2+)

but-2-en-2-ylbenzene;tungsten(2+) (PubChem CID 20767133) has the molecular formula C10H10W and a molecular weight of 314.03 g/mol. Its IUPAC name is but-2-en-2-ylbenzene;tungsten(2+).

Molecular Properties

Compound Namebut-2-en-2-ylbenzene;tungsten(2+)
PubChem CID20767133
Molecular FormulaC10H10W
Molecular Weight314.03 g/mol
Exact Mass314.03
IUPAC Namebut-2-en-2-ylbenzene;tungsten(2+)
SMILESC/[C-]=C(\C)c1[c-]cccc1.[W+2]
InChIInChI=1S/C10H10.W/c1-3-9(2)10-7-5-4-6-8-10;/h4-7H,1-2H3;/q-2;+2
InChIKeyIWBNCWYJNROSEH-UHFFFAOYSA-N
XLogP2.71
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.03
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 but-2-en-2-ylbenzene;tungsten(2+)?
The IUPAC name of but-2-en-2-ylbenzene;tungsten(2+) (CID 20767133) is but-2-en-2-ylbenzene;tungsten(2+).
What is the SMILES notation for but-2-en-2-ylbenzene;tungsten(2+)?
The canonical SMILES for but-2-en-2-ylbenzene;tungsten(2+) is C/[C-]=C(\C)c1[c-]cccc1.[W+2].
What is the InChIKey of but-2-en-2-ylbenzene;tungsten(2+)?
The InChIKey is IWBNCWYJNROSEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10.W/c1-3-9(2)10-7-5-4-6-8-10;/h4-7H,1-2H3;/q-2;+2.
What are the key properties of but-2-en-2-ylbenzene;tungsten(2+)?
but-2-en-2-ylbenzene;tungsten(2+) has a molecular weight of 314.03 g/mol, XLogP of 2.71, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for but-2-en-2-ylbenzene;tungsten(2+) is sourced from PubChem (CID 20767133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).