uranium;hexaacetate;hydrate

C12H20O13U-6 — CID 174392556

IUPACuranium;hexaacetate;hydrate
SMILESCC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].O.[U]
InChIInChI=1S/6C2H4O2.H2O.U/c6*1-2(3)4;;/h6*1H3,(H,3,4);1H2;/p-6
InChIKeySMSKVYAPIGQSRC-UHFFFAOYSA-H
MW610.31 g/mol
LogP-8.29
Rot. Bonds

About uranium;hexaacetate;hydrate

uranium;hexaacetate;hydrate (PubChem CID 174392556) has the molecular formula C12H20O13U-6 and a molecular weight of 610.31 g/mol. Its IUPAC name is uranium;hexaacetate;hydrate.

Molecular Properties

Compound Nameuranium;hexaacetate;hydrate
PubChem CID174392556
Molecular FormulaC12H20O13U-6
Molecular Weight610.31 g/mol
Exact Mass610.14
IUPAC Nameuranium;hexaacetate;hydrate
SMILESCC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].O.[U]
InChIInChI=1S/6C2H4O2.H2O.U/c6*1-2(3)4;;/h6*1H3,(H,3,4);1H2;/p-6
InChIKeySMSKVYAPIGQSRC-UHFFFAOYSA-H
XLogP-8.29
TPSA272.28 Ų
H-Bond Donors
H-Bond Acceptors12
Rotatable Bonds
Heavy Atoms26
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500610.31
LogP ≤ 5-8.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1012

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Related Compounds

uranium hexaacetate
CID 20541057
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vanadium;triacetate;hydrate
CID 102418603
cerium(3+);acetate;hexahydrate
CID 23158452
sodium;acetate;trihydrate
CID 23665404
iron(2+);diacetate;heptahydrate
CID 173209391
zinc;diacetate;heptahydrate
CID 161319738
praseodymium(3+);triacetate;trihydrate
CID 172733090
CID 170997536
CID 170997536
tin(2+);diacetate;dihydrate
CID 174049693
strontium;acetate;hexahydrate
CID 19795582
cobalt(2+);acetate;hexahydrate
CID 21479533

Frequently Asked Questions

What is the IUPAC name of uranium;hexaacetate;hydrate?
The IUPAC name of uranium;hexaacetate;hydrate (CID 174392556) is uranium;hexaacetate;hydrate.
What is the SMILES notation for uranium;hexaacetate;hydrate?
The canonical SMILES for uranium;hexaacetate;hydrate is CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].CC(=O)[O-].O.[U].
What is the InChIKey of uranium;hexaacetate;hydrate?
The InChIKey is SMSKVYAPIGQSRC-UHFFFAOYSA-H. The full InChI is InChI=1S/6C2H4O2.H2O.U/c6*1-2(3)4;;/h6*1H3,(H,3,4);1H2;/p-6.
What are the key properties of uranium;hexaacetate;hydrate?
uranium;hexaacetate;hydrate has a molecular weight of 610.31 g/mol, XLogP of -8.29, 0 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for uranium;hexaacetate;hydrate is sourced from PubChem (CID 174392556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).