diiodovanadium;2,3,4,5-tetramethylhexa-2,4-diene

C10H18I2V — CID 160905465

IUPACdiiodovanadium;2,3,4,5-tetramethylhexa-2,4-diene
SMILESCC(C)=C(C)C(C)=C(C)C.I[V]I
InChIInChI=1S/C10H18.2HI.V/c1-7(2)9(5)10(6)8(3)4;;;/h1-6H3;2*1H;/q;;;+2/p-2
InChIKeySQBUZQZWPDKBNC-UHFFFAOYSA-L
MW443.01 g/mol
LogP5.47
Rot. Bonds1

About diiodovanadium;2,3,4,5-tetramethylhexa-2,4-diene

diiodovanadium;2,3,4,5-tetramethylhexa-2,4-diene (PubChem CID 160905465) has the molecular formula C10H18I2V and a molecular weight of 443.01 g/mol. Its IUPAC name is diiodovanadium;2,3,4,5-tetramethylhexa-2,4-diene.

Molecular Properties

Compound Namediiodovanadium;2,3,4,5-tetramethylhexa-2,4-diene
PubChem CID160905465
Molecular FormulaC10H18I2V
Molecular Weight443.01 g/mol
Exact Mass442.89
IUPAC Namediiodovanadium;2,3,4,5-tetramethylhexa-2,4-diene
SMILESCC(C)=C(C)C(C)=C(C)C.I[V]I
InChIInChI=1S/C10H18.2HI.V/c1-7(2)9(5)10(6)8(3)4;;;/h1-6H3;2*1H;/q;;;+2/p-2
InChIKeySQBUZQZWPDKBNC-UHFFFAOYSA-L
XLogP5.47
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500443.01
LogP ≤ 55.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

2,3,4,5-Tetramethylhexa-2,4-diene
CID 635468
(2Z,4Z)-2,5-diiodo-3,4-dimethylhexa-2,4-diene
CID 11013883
(3Z,5Z)-3,6-diiodo-2,2,4,5,7,7-hexamethylocta-3,5-diene
CID 12981007
(4E)-2,3,4,5-tetramethylhepta-2,4-diene
CID 18738646
Carbanide;1,2,3,4,5-pentamethylbenzene-6-ide;tungsten;vanadium(2+)
CID 20614941
Carbanide;1,2,3,4,5-pentamethylbenzene-6-ide;vanadium(2+)
CID 20672733
2,3,4,5,6,7-Hexamethylocta-2,4,6-triene
CID 58944348
(4Z)-2,3,4,5-tetramethylhepta-2,4-diene
CID 59889955
2,3,4,5-Tetramethylhepta-2,4-diene
CID 73461532
2,4,5,6-Tetramethylhepta-2,3,5-triene
CID 124021298
Ethane;2,3,4,5-tetramethylhexa-2,4-diene
CID 141770935
Ethene;molecular iodine;2,3,4-trimethylpenta-1,3-diene
CID 143098183

Frequently Asked Questions

What is the IUPAC name of diiodovanadium;2,3,4,5-tetramethylhexa-2,4-diene?
The IUPAC name of diiodovanadium;2,3,4,5-tetramethylhexa-2,4-diene (CID 160905465) is diiodovanadium;2,3,4,5-tetramethylhexa-2,4-diene.
What is the SMILES notation for diiodovanadium;2,3,4,5-tetramethylhexa-2,4-diene?
The canonical SMILES for diiodovanadium;2,3,4,5-tetramethylhexa-2,4-diene is CC(C)=C(C)C(C)=C(C)C.I[V]I.
What is the InChIKey of diiodovanadium;2,3,4,5-tetramethylhexa-2,4-diene?
The InChIKey is SQBUZQZWPDKBNC-UHFFFAOYSA-L. The full InChI is InChI=1S/C10H18.2HI.V/c1-7(2)9(5)10(6)8(3)4;;;/h1-6H3;2*1H;/q;;;+2/p-2.
What are the key properties of diiodovanadium;2,3,4,5-tetramethylhexa-2,4-diene?
diiodovanadium;2,3,4,5-tetramethylhexa-2,4-diene has a molecular weight of 443.01 g/mol, XLogP of 5.47, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for diiodovanadium;2,3,4,5-tetramethylhexa-2,4-diene is sourced from PubChem (CID 160905465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).