[(2Z)-2,3,4-trimethylpenta-2,4-dienylidene]tungsten

C8H12W — CID 59085840

IUPAC[(2Z)-2,3,4-trimethylpenta-2,4-dienylidene]tungsten
SMILESC=C(C)/C(C)=C(/C)C=[W]
InChIInChI=1S/C8H12.W/c1-6(2)8(5)7(3)4;/h1H,3H2,2,4-5H3;/b8-6+;
InChIKeyHBHUPWBXSAFUTR-WVLIHFOGSA-N
MW292.02 g/mol
LogP2.25
Rot. Bonds2

About [(2Z)-2,3,4-trimethylpenta-2,4-dienylidene]tungsten

[(2Z)-2,3,4-trimethylpenta-2,4-dienylidene]tungsten (PubChem CID 59085840) has the molecular formula C8H12W and a molecular weight of 292.02 g/mol. Its IUPAC name is [(2Z)-2,3,4-trimethylpenta-2,4-dienylidene]tungsten.

Molecular Properties

Compound Name[(2Z)-2,3,4-trimethylpenta-2,4-dienylidene]tungsten
PubChem CID59085840
Molecular FormulaC8H12W
Molecular Weight292.02 g/mol
Exact Mass292.04
IUPAC Name[(2Z)-2,3,4-trimethylpenta-2,4-dienylidene]tungsten
SMILESC=C(C)/C(C)=C(/C)C=[W]
InChIInChI=1S/C8H12.W/c1-6(2)8(5)7(3)4;/h1H,3H2,2,4-5H3;/b8-6+;
InChIKeyHBHUPWBXSAFUTR-WVLIHFOGSA-N
XLogP2.25
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.02
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

(3E)-2,3,4-trimethylhepta-1,3,5-triene
CID 161260818
3,4-dimethylpenta-2,4-dien-2-ylsilane
CID 154334462
(3E,5Z)-2,3,5-trimethyl-4-prop-1-en-2-ylhepta-1,3,5-triene
CID 170590515
2,3-dimethylbuta-1,3-diene;ethane
CID 156868132
2,4-dimethyl-3-prop-1-en-2-ylpenta-1,3-diene
CID 142833996
2-methyl(113C)prop-2-enal
CID 71749931
(2E)-2-ethenyl-3,4-dimethylpenta-2,4-dien-1-amine
CID 142547585
(3E,6E)-2,3,4,6-tetramethylocta-1,3,6-triene
CID 20695183
oxaldehydoyl 2-methylprop-2-enoate
CID 87845932
(3Z,5E)-5-ethenyl-2,3,4-trimethylocta-1,3,5,7-tetraene
CID 144588079
(3E)-2,3,4,5,5,6-hexamethylocta-1,3,6-triene
CID 157075274
(3Z,6E)-6-ethenyl-2,3,4-trimethyl-5-methylideneocta-1,3,6-triene
CID 164855515

Frequently Asked Questions

What is the IUPAC name of [(2Z)-2,3,4-trimethylpenta-2,4-dienylidene]tungsten?
The IUPAC name of [(2Z)-2,3,4-trimethylpenta-2,4-dienylidene]tungsten (CID 59085840) is [(2Z)-2,3,4-trimethylpenta-2,4-dienylidene]tungsten.
What is the SMILES notation for [(2Z)-2,3,4-trimethylpenta-2,4-dienylidene]tungsten?
The canonical SMILES for [(2Z)-2,3,4-trimethylpenta-2,4-dienylidene]tungsten is C=C(C)/C(C)=C(/C)C=[W].
What is the InChIKey of [(2Z)-2,3,4-trimethylpenta-2,4-dienylidene]tungsten?
The InChIKey is HBHUPWBXSAFUTR-WVLIHFOGSA-N. The full InChI is InChI=1S/C8H12.W/c1-6(2)8(5)7(3)4;/h1H,3H2,2,4-5H3;/b8-6+;.
What are the key properties of [(2Z)-2,3,4-trimethylpenta-2,4-dienylidene]tungsten?
[(2Z)-2,3,4-trimethylpenta-2,4-dienylidene]tungsten has a molecular weight of 292.02 g/mol, XLogP of 2.25, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(2Z)-2,3,4-trimethylpenta-2,4-dienylidene]tungsten is sourced from PubChem (CID 59085840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).