acetic acid;diacetyloxystibanyl acetate;zinc

C10H17O10SbZn — CID 175934647

IUPACacetic acid;diacetyloxystibanyl acetate;zinc
SMILESCC(=O)O.CC(=O)O.CC(=O)O[Sb](OC(C)=O)OC(C)=O.[Zn]
InChIInChI=1S/5C2H4O2.Sb.Zn/c5*1-2(3)4;;/h5*1H3,(H,3,4);;/q;;;;;+3;/p-3
InChIKeyDEWMXSZTTRMHTP-UHFFFAOYSA-K
MW484.39 g/mol
LogP-0.16
Rot. Bonds3

About acetic acid;diacetyloxystibanyl acetate;zinc

acetic acid;diacetyloxystibanyl acetate;zinc (PubChem CID 175934647) has the molecular formula C10H17O10SbZn and a molecular weight of 484.39 g/mol. Its IUPAC name is acetic acid;diacetyloxystibanyl acetate;zinc.

Molecular Properties

Compound Nameacetic acid;diacetyloxystibanyl acetate;zinc
PubChem CID175934647
Molecular FormulaC10H17O10SbZn
Molecular Weight484.39 g/mol
Exact Mass481.92
IUPAC Nameacetic acid;diacetyloxystibanyl acetate;zinc
SMILESCC(=O)O.CC(=O)O.CC(=O)O[Sb](OC(C)=O)OC(C)=O.[Zn]
InChIInChI=1S/5C2H4O2.Sb.Zn/c5*1-2(3)4;;/h5*1H3,(H,3,4);;/q;;;;;+3;/p-3
InChIKeyDEWMXSZTTRMHTP-UHFFFAOYSA-K
XLogP-0.16
TPSA153.50 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500484.39
LogP ≤ 5-0.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

diacetyloxystibanyl acetate
CID 16685080
acetic acid;ruthenium
CID 175502908
acetic acid;alumanyl acetate
CID 174439489
(dioxo-λ5-stibanyl) acetate
CID 139631794
acetic acid;zinc;trihydrate
CID 173017451
acetic acid;gold;zinc
CID 170551758
acetic acid;sulfane;zinc
CID 175305770
acetic acid;zinc;nonahydrate
CID 174979738
acetic acid
CID 158444727
bis(2-hydroxyethoxy)stibanyl acetate
CID 16684127
chloro acetate;yttrium
CID 174640124
CID 172779404
CID 172779404

Frequently Asked Questions

What is the IUPAC name of acetic acid;diacetyloxystibanyl acetate;zinc?
The IUPAC name of acetic acid;diacetyloxystibanyl acetate;zinc (CID 175934647) is acetic acid;diacetyloxystibanyl acetate;zinc.
What is the SMILES notation for acetic acid;diacetyloxystibanyl acetate;zinc?
The canonical SMILES for acetic acid;diacetyloxystibanyl acetate;zinc is CC(=O)O.CC(=O)O.CC(=O)O[Sb](OC(C)=O)OC(C)=O.[Zn].
What is the InChIKey of acetic acid;diacetyloxystibanyl acetate;zinc?
The InChIKey is DEWMXSZTTRMHTP-UHFFFAOYSA-K. The full InChI is InChI=1S/5C2H4O2.Sb.Zn/c5*1-2(3)4;;/h5*1H3,(H,3,4);;/q;;;;;+3;/p-3.
What are the key properties of acetic acid;diacetyloxystibanyl acetate;zinc?
acetic acid;diacetyloxystibanyl acetate;zinc has a molecular weight of 484.39 g/mol, XLogP of -0.16, 3 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for acetic acid;diacetyloxystibanyl acetate;zinc is sourced from PubChem (CID 175934647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).