henicosamagnesium;acetic acid;hydride

C10H62Mg21O10 — CID 173442224

IUPAChenicosamagnesium;acetic acid;hydride
SMILESCC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2]
InChIInChI=1S/5C2H4O2.21Mg.42H/c5*1-2(3)4;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/h5*1H3,(H,3,4);;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;;;;21*+2;42*-1
InChIKeyLJHHMGSDXBLOOT-UHFFFAOYSA-N
MW853.00 g/mol
LogP-2.82
Rot. Bonds

About henicosamagnesium;acetic acid;hydride

henicosamagnesium;acetic acid;hydride (PubChem CID 173442224) has the molecular formula C10H62Mg21O10 and a molecular weight of 853.00 g/mol. Its IUPAC name is henicosamagnesium;acetic acid;hydride.

Molecular Properties

Compound Namehenicosamagnesium;acetic acid;hydride
PubChem CID173442224
Molecular FormulaC10H62Mg21O10
Molecular Weight853.00 g/mol
Exact Mass846.12
IUPAC Namehenicosamagnesium;acetic acid;hydride
SMILESCC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2]
InChIInChI=1S/5C2H4O2.21Mg.42H/c5*1-2(3)4;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/h5*1H3,(H,3,4);;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;;;;21*+2;42*-1
InChIKeyLJHHMGSDXBLOOT-UHFFFAOYSA-N
XLogP-2.82
TPSA186.50 Ų
H-Bond Donors5
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms41
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500853.00
LogP ≤ 5-2.82
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 105

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Related Compounds

magnesium;acetic acid;hydride
CID 172995175
dimagnesium;acetic acid;hydride;dichloride
CID 174863271
magnesium;acetic acid;hydride;silver
CID 174410866
magnesium;acetic acid;hydride;hydrochloride
CID 173422924
magnesium;acetic acid;hydride;dihydrate
CID 173154307
dimagnesium;acetic acid;hydride;tetrahydrate
CID 174549678
magnesium;acetic acid;hydride;manganese
CID 174827254
lithium;magnesium;acetic acid;hydride;λ2-stannane
CID 174107240
magnesium;sodium;acetic acid;hydride;trihydrate
CID 173259653
potassium;acetic acid;hydride
CID 173209804
acetic acid;hydride;nickel
CID 173448047
strontium;acetic acid;hydride
CID 173216931

Frequently Asked Questions

What is the IUPAC name of henicosamagnesium;acetic acid;hydride?
The IUPAC name of henicosamagnesium;acetic acid;hydride (CID 173442224) is henicosamagnesium;acetic acid;hydride.
What is the SMILES notation for henicosamagnesium;acetic acid;hydride?
The canonical SMILES for henicosamagnesium;acetic acid;hydride is CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[H-].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].[Mg+2].
What is the InChIKey of henicosamagnesium;acetic acid;hydride?
The InChIKey is LJHHMGSDXBLOOT-UHFFFAOYSA-N. The full InChI is InChI=1S/5C2H4O2.21Mg.42H/c5*1-2(3)4;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/h5*1H3,(H,3,4);;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;;;;21*+2;42*-1.
What are the key properties of henicosamagnesium;acetic acid;hydride?
henicosamagnesium;acetic acid;hydride has a molecular weight of 853.00 g/mol, XLogP of -2.82, 0 rotatable bonds, 5 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for henicosamagnesium;acetic acid;hydride is sourced from PubChem (CID 173442224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).