1,4-dimethanidylcyclohexane;tungsten;vanadium

C8H14VW-2 — CID 172528900

IUPAC1,4-dimethanidylcyclohexane;tungsten;vanadium
SMILES[CH2-]C1CCC([CH2-])CC1.[V].[W]
InChIInChI=1S/C8H14.V.W/c1-7-3-5-8(2)6-4-7;;/h7-8H,1-6H2;;/q-2;;
InChIKeyWPVDIACAHYMQJX-UHFFFAOYSA-N
MW344.98 g/mol
LogP2.46
Rot. Bonds

About 1,4-dimethanidylcyclohexane;tungsten;vanadium

1,4-dimethanidylcyclohexane;tungsten;vanadium (PubChem CID 172528900) has the molecular formula C8H14VW-2 and a molecular weight of 344.98 g/mol. Its IUPAC name is 1,4-dimethanidylcyclohexane;tungsten;vanadium.

Molecular Properties

Compound Name1,4-dimethanidylcyclohexane;tungsten;vanadium
PubChem CID172528900
Molecular FormulaC8H14VW-2
Molecular Weight344.98 g/mol
Exact Mass345.01
IUPAC Name1,4-dimethanidylcyclohexane;tungsten;vanadium
SMILES[CH2-]C1CCC([CH2-])CC1.[V].[W]
InChIInChI=1S/C8H14.V.W/c1-7-3-5-8(2)6-4-7;;/h7-8H,1-6H2;;/q-2;;
InChIKeyWPVDIACAHYMQJX-UHFFFAOYSA-N
XLogP2.46
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.98
LogP ≤ 52.46
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 1,4-dimethanidylcyclohexane;tungsten;vanadium?
The IUPAC name of 1,4-dimethanidylcyclohexane;tungsten;vanadium (CID 172528900) is 1,4-dimethanidylcyclohexane;tungsten;vanadium.
What is the SMILES notation for 1,4-dimethanidylcyclohexane;tungsten;vanadium?
The canonical SMILES for 1,4-dimethanidylcyclohexane;tungsten;vanadium is [CH2-]C1CCC([CH2-])CC1.[V].[W].
What is the InChIKey of 1,4-dimethanidylcyclohexane;tungsten;vanadium?
The InChIKey is WPVDIACAHYMQJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14.V.W/c1-7-3-5-8(2)6-4-7;;/h7-8H,1-6H2;;/q-2;;.
What are the key properties of 1,4-dimethanidylcyclohexane;tungsten;vanadium?
1,4-dimethanidylcyclohexane;tungsten;vanadium has a molecular weight of 344.98 g/mol, XLogP of 2.46, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dimethanidylcyclohexane;tungsten;vanadium is sourced from PubChem (CID 172528900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).