carbanide;ethene;hydroperoxymethane;bis(2-hydroxyethyl hypofluorite);methane;uranium

C19H61F2O8U3- — CID 158476719

IUPACcarbanide;ethene;hydroperoxymethane;bis(2-hydroxyethyl hypofluorite);methane;uranium
SMILESC.C.C.C.C.C.C.C.C=C.C=C.COO.COO.OCCOF.OCCOF.[CH3-].[U].[U].[U]
InChIInChI=1S/2C2H5FO2.2C2H4.2CH4O2.8CH4.CH3.3U/c2*3-5-2-1-4;2*1-2;2*1-3-2;;;;;;;;;;;;/h2*4H,1-2H2;2*1-2H2;2*2H,1H3;8*1H4;1H3;;;/q;;;;;;;;;;;;;;-1;;;
InChIKeyRIALDPHTIYNGTL-UHFFFAOYSA-N
MW1169.77 g/mol
LogP7.11
Rot. Bonds4

About carbanide;ethene;hydroperoxymethane;bis(2-hydroxyethyl hypofluorite);methane;uranium

carbanide;ethene;hydroperoxymethane;bis(2-hydroxyethyl hypofluorite);methane;uranium (PubChem CID 158476719) has the molecular formula C19H61F2O8U3- and a molecular weight of 1169.77 g/mol. Its IUPAC name is carbanide;ethene;hydroperoxymethane;bis(2-hydroxyethyl hypofluorite);methane;uranium.

Molecular Properties

Compound Namecarbanide;ethene;hydroperoxymethane;bis(2-hydroxyethyl hypofluorite);methane;uranium
PubChem CID158476719
Molecular FormulaC19H61F2O8U3-
Molecular Weight1169.77 g/mol
Exact Mass1169.59
IUPAC Namecarbanide;ethene;hydroperoxymethane;bis(2-hydroxyethyl hypofluorite);methane;uranium
SMILESC.C.C.C.C.C.C.C.C=C.C=C.COO.COO.OCCOF.OCCOF.[CH3-].[U].[U].[U]
InChIInChI=1S/2C2H5FO2.2C2H4.2CH4O2.8CH4.CH3.3U/c2*3-5-2-1-4;2*1-2;2*1-3-2;;;;;;;;;;;;/h2*4H,1-2H2;2*1-2H2;2*2H,1H3;8*1H4;1H3;;;/q;;;;;;;;;;;;;;-1;;;
InChIKeyRIALDPHTIYNGTL-UHFFFAOYSA-N
XLogP7.11
TPSA117.84 Ų
H-Bond Donors4
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms32
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001169.77
LogP ≤ 57.11
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of carbanide;ethene;hydroperoxymethane;bis(2-hydroxyethyl hypofluorite);methane;uranium?
The IUPAC name of carbanide;ethene;hydroperoxymethane;bis(2-hydroxyethyl hypofluorite);methane;uranium (CID 158476719) is carbanide;ethene;hydroperoxymethane;bis(2-hydroxyethyl hypofluorite);methane;uranium.
What is the SMILES notation for carbanide;ethene;hydroperoxymethane;bis(2-hydroxyethyl hypofluorite);methane;uranium?
The canonical SMILES for carbanide;ethene;hydroperoxymethane;bis(2-hydroxyethyl hypofluorite);methane;uranium is C.C.C.C.C.C.C.C.C=C.C=C.COO.COO.OCCOF.OCCOF.[CH3-].[U].[U].[U].
What is the InChIKey of carbanide;ethene;hydroperoxymethane;bis(2-hydroxyethyl hypofluorite);methane;uranium?
The InChIKey is RIALDPHTIYNGTL-UHFFFAOYSA-N. The full InChI is InChI=1S/2C2H5FO2.2C2H4.2CH4O2.8CH4.CH3.3U/c2*3-5-2-1-4;2*1-2;2*1-3-2;;;;;;;;;;;;/h2*4H,1-2H2;2*1-2H2;2*2H,1H3;8*1H4;1H3;;;/q;;;;;;;;;;;;;;-1;;;.
What are the key properties of carbanide;ethene;hydroperoxymethane;bis(2-hydroxyethyl hypofluorite);methane;uranium?
carbanide;ethene;hydroperoxymethane;bis(2-hydroxyethyl hypofluorite);methane;uranium has a molecular weight of 1169.77 g/mol, XLogP of 7.11, 4 rotatable bonds, 4 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for carbanide;ethene;hydroperoxymethane;bis(2-hydroxyethyl hypofluorite);methane;uranium is sourced from PubChem (CID 158476719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).