hexane;uranium

C6H12U3-2 — CID 163483777

IUPAChexane;uranium
SMILES[CH2-]CCCC[CH2-].[U].[U].[U]
InChIInChI=1S/C6H12.3U/c1-3-5-6-4-2;;;/h1-6H2;;;/q-2;;;
InChIKeyDQVXLDKQQMTAPD-UHFFFAOYSA-N
MW798.25 g/mol
LogP2.21
Rot. Bonds3

About hexane;uranium

hexane;uranium (PubChem CID 163483777) has the molecular formula C6H12U3-2 and a molecular weight of 798.25 g/mol. Its IUPAC name is hexane;uranium.

Molecular Properties

Compound Namehexane;uranium
PubChem CID163483777
Molecular FormulaC6H12U3-2
Molecular Weight798.25 g/mol
Exact Mass798.25
IUPAC Namehexane;uranium
SMILES[CH2-]CCCC[CH2-].[U].[U].[U]
InChIInChI=1S/C6H12.3U/c1-3-5-6-4-2;;;/h1-6H2;;;/q-2;;;
InChIKeyDQVXLDKQQMTAPD-UHFFFAOYSA-N
XLogP2.21
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500798.25
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Related Compounds

dimagnesium;dodecane;dibromide
CID 11760597
dimagnesium;hexane;dibromide
CID 10334549
heptadecane
CID 156905849
zinc heptane
CID 4204916
dodecane;zirconium
CID 148549415
cerium;dodecane
CID 154114371
bis(octane);zinc
CID 175041964
tris(heptane);vanadium
CID 59340167
1-iodohexane;zinc
CID 87180857
sodium tritriacontane
CID 150964196
tetrakis(heptane);zirconium(4+)
CID 154501032
lithium tridecane
CID 11321439

Frequently Asked Questions

What is the IUPAC name of hexane;uranium?
The IUPAC name of hexane;uranium (CID 163483777) is hexane;uranium.
What is the SMILES notation for hexane;uranium?
The canonical SMILES for hexane;uranium is [CH2-]CCCC[CH2-].[U].[U].[U].
What is the InChIKey of hexane;uranium?
The InChIKey is DQVXLDKQQMTAPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12.3U/c1-3-5-6-4-2;;;/h1-6H2;;;/q-2;;;.
What are the key properties of hexane;uranium?
hexane;uranium has a molecular weight of 798.25 g/mol, XLogP of 2.21, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for hexane;uranium is sourced from PubChem (CID 163483777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).