[methoxy-[6-methoxy-8-[(E)-1-phenylprop-1-en-2-yl]-7-bicyclo[4.2.0]oct-7-enyl]methylidene]tungsten

C20H24O2W — CID 134884590

IUPAC[methoxy-[6-methoxy-8-[(E)-1-phenylprop-1-en-2-yl]-7-bicyclo[4.2.0]oct-7-enyl]methylidene]tungsten
SMILESCOC(=[W])C1=C(/C(C)=C/c2ccccc2)C2CCCCC12OC
InChIInChI=1S/C20H24O2.W/c1-15(13-16-9-5-4-6-10-16)19-17-11-7-8-12-20(17,22-3)18(19)14-21-2;/h4-6,9-10,13,17H,7-8,11-12H2,1-3H3;/b15-13+;
InChIKeyPGVDKPHPWTWFOS-GVYCEHEKSA-N
MW480.25 g/mol
LogP4.30
Rot. Bonds5

About [methoxy-[6-methoxy-8-[(E)-1-phenylprop-1-en-2-yl]-7-bicyclo[4.2.0]oct-7-enyl]methylidene]tungsten

[methoxy-[6-methoxy-8-[(E)-1-phenylprop-1-en-2-yl]-7-bicyclo[4.2.0]oct-7-enyl]methylidene]tungsten (PubChem CID 134884590) has the molecular formula C20H24O2W and a molecular weight of 480.25 g/mol. Its IUPAC name is [methoxy-[6-methoxy-8-[(E)-1-phenylprop-1-en-2-yl]-7-bicyclo[4.2.0]oct-7-enyl]methylidene]tungsten.

Molecular Properties

Compound Name[methoxy-[6-methoxy-8-[(E)-1-phenylprop-1-en-2-yl]-7-bicyclo[4.2.0]oct-7-enyl]methylidene]tungsten
PubChem CID134884590
Molecular FormulaC20H24O2W
Molecular Weight480.25 g/mol
Exact Mass480.13
IUPAC Name[methoxy-[6-methoxy-8-[(E)-1-phenylprop-1-en-2-yl]-7-bicyclo[4.2.0]oct-7-enyl]methylidene]tungsten
SMILESCOC(=[W])C1=C(/C(C)=C/c2ccccc2)C2CCCCC12OC
InChIInChI=1S/C20H24O2.W/c1-15(13-16-9-5-4-6-10-16)19-17-11-7-8-12-20(17,22-3)18(19)14-21-2;/h4-6,9-10,13,17H,7-8,11-12H2,1-3H3;/b15-13+;
InChIKeyPGVDKPHPWTWFOS-GVYCEHEKSA-N
XLogP4.30
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500480.25
LogP ≤ 54.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [methoxy-[6-methoxy-8-[(E)-1-phenylprop-1-en-2-yl]-7-bicyclo[4.2.0]oct-7-enyl]methylidene]tungsten?
The IUPAC name of [methoxy-[6-methoxy-8-[(E)-1-phenylprop-1-en-2-yl]-7-bicyclo[4.2.0]oct-7-enyl]methylidene]tungsten (CID 134884590) is [methoxy-[6-methoxy-8-[(E)-1-phenylprop-1-en-2-yl]-7-bicyclo[4.2.0]oct-7-enyl]methylidene]tungsten.
What is the SMILES notation for [methoxy-[6-methoxy-8-[(E)-1-phenylprop-1-en-2-yl]-7-bicyclo[4.2.0]oct-7-enyl]methylidene]tungsten?
The canonical SMILES for [methoxy-[6-methoxy-8-[(E)-1-phenylprop-1-en-2-yl]-7-bicyclo[4.2.0]oct-7-enyl]methylidene]tungsten is COC(=[W])C1=C(/C(C)=C/c2ccccc2)C2CCCCC12OC.
What is the InChIKey of [methoxy-[6-methoxy-8-[(E)-1-phenylprop-1-en-2-yl]-7-bicyclo[4.2.0]oct-7-enyl]methylidene]tungsten?
The InChIKey is PGVDKPHPWTWFOS-GVYCEHEKSA-N. The full InChI is InChI=1S/C20H24O2.W/c1-15(13-16-9-5-4-6-10-16)19-17-11-7-8-12-20(17,22-3)18(19)14-21-2;/h4-6,9-10,13,17H,7-8,11-12H2,1-3H3;/b15-13+;.
What are the key properties of [methoxy-[6-methoxy-8-[(E)-1-phenylprop-1-en-2-yl]-7-bicyclo[4.2.0]oct-7-enyl]methylidene]tungsten?
[methoxy-[6-methoxy-8-[(E)-1-phenylprop-1-en-2-yl]-7-bicyclo[4.2.0]oct-7-enyl]methylidene]tungsten has a molecular weight of 480.25 g/mol, XLogP of 4.30, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [methoxy-[6-methoxy-8-[(E)-1-phenylprop-1-en-2-yl]-7-bicyclo[4.2.0]oct-7-enyl]methylidene]tungsten is sourced from PubChem (CID 134884590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).