1-cyclohexyl-4-methylcyclohexane;methylcyclohexane;tungsten;uranium(2+)

C20H36UW2 — CID 59386265

IUPAC1-cyclohexyl-4-methylcyclohexane;methylcyclohexane;tungsten;uranium(2+)
SMILESCC1CCC(C2CC[CH-]CC2)CC1.CC1CC[CH-]CC1.[U+2].[W].[W]
InChIInChI=1S/C13H23.C7H13.U.2W/c1-11-7-9-13(10-8-11)12-5-3-2-4-6-12;1-7-5-3-2-4-6-7;;;/h2,11-13H,3-10H2,1H3;2,7H,3-6H2,1H3;;;/q2*-1;+2;;
InChIKeyXUTFWILGWDSXBZ-UHFFFAOYSA-N
MW882.22 g/mol
LogP6.60
Rot. Bonds1

About 1-cyclohexyl-4-methylcyclohexane;methylcyclohexane;tungsten;uranium(2+)

1-cyclohexyl-4-methylcyclohexane;methylcyclohexane;tungsten;uranium(2+) (PubChem CID 59386265) has the molecular formula C20H36UW2 and a molecular weight of 882.22 g/mol. Its IUPAC name is 1-cyclohexyl-4-methylcyclohexane;methylcyclohexane;tungsten;uranium(2+).

Molecular Properties

Compound Name1-cyclohexyl-4-methylcyclohexane;methylcyclohexane;tungsten;uranium(2+)
PubChem CID59386265
Molecular FormulaC20H36UW2
Molecular Weight882.22 g/mol
Exact Mass882.23
IUPAC Name1-cyclohexyl-4-methylcyclohexane;methylcyclohexane;tungsten;uranium(2+)
SMILESCC1CCC(C2CC[CH-]CC2)CC1.CC1CC[CH-]CC1.[U+2].[W].[W]
InChIInChI=1S/C13H23.C7H13.U.2W/c1-11-7-9-13(10-8-11)12-5-3-2-4-6-12;1-7-5-3-2-4-6-7;;;/h2,11-13H,3-10H2,1H3;2,7H,3-6H2,1H3;;;/q2*-1;+2;;
InChIKeyXUTFWILGWDSXBZ-UHFFFAOYSA-N
XLogP6.60
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms23
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500882.22
LogP ≤ 56.60
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-cyclohexyl-4-methylcyclohexane;methylcyclohexane;tungsten;uranium(2+)?
The IUPAC name of 1-cyclohexyl-4-methylcyclohexane;methylcyclohexane;tungsten;uranium(2+) (CID 59386265) is 1-cyclohexyl-4-methylcyclohexane;methylcyclohexane;tungsten;uranium(2+).
What is the SMILES notation for 1-cyclohexyl-4-methylcyclohexane;methylcyclohexane;tungsten;uranium(2+)?
The canonical SMILES for 1-cyclohexyl-4-methylcyclohexane;methylcyclohexane;tungsten;uranium(2+) is CC1CCC(C2CC[CH-]CC2)CC1.CC1CC[CH-]CC1.[U+2].[W].[W].
What is the InChIKey of 1-cyclohexyl-4-methylcyclohexane;methylcyclohexane;tungsten;uranium(2+)?
The InChIKey is XUTFWILGWDSXBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23.C7H13.U.2W/c1-11-7-9-13(10-8-11)12-5-3-2-4-6-12;1-7-5-3-2-4-6-7;;;/h2,11-13H,3-10H2,1H3;2,7H,3-6H2,1H3;;;/q2*-1;+2;;.
What are the key properties of 1-cyclohexyl-4-methylcyclohexane;methylcyclohexane;tungsten;uranium(2+)?
1-cyclohexyl-4-methylcyclohexane;methylcyclohexane;tungsten;uranium(2+) has a molecular weight of 882.22 g/mol, XLogP of 6.60, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-4-methylcyclohexane;methylcyclohexane;tungsten;uranium(2+) is sourced from PubChem (CID 59386265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).