1-(2-but-2-en-2-ylphenyl)ethylidenetungsten

C12H14W — CID 161267219

IUPAC1-(2-but-2-en-2-ylphenyl)ethylidenetungsten
SMILESCC=C(C)c1ccccc1C(C)=[W]
InChIInChI=1S/C12H14.W/c1-4-10(3)12-9-7-6-8-11(12)5-2;/h4,6-9H,1-3H3;
InChIKeyULEWIZZKJQCHQF-UHFFFAOYSA-N
MW342.08 g/mol
LogP3.20
Rot. Bonds2

About 1-(2-but-2-en-2-ylphenyl)ethylidenetungsten

1-(2-but-2-en-2-ylphenyl)ethylidenetungsten (PubChem CID 161267219) has the molecular formula C12H14W and a molecular weight of 342.08 g/mol. Its IUPAC name is 1-(2-but-2-en-2-ylphenyl)ethylidenetungsten.

Molecular Properties

Compound Name1-(2-but-2-en-2-ylphenyl)ethylidenetungsten
PubChem CID161267219
Molecular FormulaC12H14W
Molecular Weight342.08 g/mol
Exact Mass342.06
IUPAC Name1-(2-but-2-en-2-ylphenyl)ethylidenetungsten
SMILESCC=C(C)c1ccccc1C(C)=[W]
InChIInChI=1S/C12H14.W/c1-4-10(3)12-9-7-6-8-11(12)5-2;/h4,6-9H,1-3H3;
InChIKeyULEWIZZKJQCHQF-UHFFFAOYSA-N
XLogP3.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.08
LogP ≤ 53.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-(2-but-2-en-2-ylphenyl)ethylidenetungsten?
The IUPAC name of 1-(2-but-2-en-2-ylphenyl)ethylidenetungsten (CID 161267219) is 1-(2-but-2-en-2-ylphenyl)ethylidenetungsten.
What is the SMILES notation for 1-(2-but-2-en-2-ylphenyl)ethylidenetungsten?
The canonical SMILES for 1-(2-but-2-en-2-ylphenyl)ethylidenetungsten is CC=C(C)c1ccccc1C(C)=[W].
What is the InChIKey of 1-(2-but-2-en-2-ylphenyl)ethylidenetungsten?
The InChIKey is ULEWIZZKJQCHQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14.W/c1-4-10(3)12-9-7-6-8-11(12)5-2;/h4,6-9H,1-3H3;.
What are the key properties of 1-(2-but-2-en-2-ylphenyl)ethylidenetungsten?
1-(2-but-2-en-2-ylphenyl)ethylidenetungsten has a molecular weight of 342.08 g/mol, XLogP of 3.20, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-but-2-en-2-ylphenyl)ethylidenetungsten is sourced from PubChem (CID 161267219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).