dizinc;carbanide;ethane-1,1,2,2-tetrol

C6H18O4Zn2 — CID 59911813

IUPACdizinc;carbanide;ethane-1,1,2,2-tetrol
SMILESOC(O)C(O)O.[CH3-].[CH3-].[CH3-].[CH3-].[Zn+2].[Zn+2]
InChIInChI=1S/C2H6O4.4CH3.2Zn/c3-1(4)2(5)6;;;;;;/h1-6H;4*1H3;;/q;4*-1;2*+2
InChIKeyDGXDSDLYDPCAJH-UHFFFAOYSA-N
MW284.99 g/mol
LogP-0.60
Rot. Bonds1

About dizinc;carbanide;ethane-1,1,2,2-tetrol

dizinc;carbanide;ethane-1,1,2,2-tetrol (PubChem CID 59911813) has the molecular formula C6H18O4Zn2 and a molecular weight of 284.99 g/mol. Its IUPAC name is dizinc;carbanide;ethane-1,1,2,2-tetrol.

Molecular Properties

Compound Namedizinc;carbanide;ethane-1,1,2,2-tetrol
PubChem CID59911813
Molecular FormulaC6H18O4Zn2
Molecular Weight284.99 g/mol
Exact Mass281.98
IUPAC Namedizinc;carbanide;ethane-1,1,2,2-tetrol
SMILESOC(O)C(O)O.[CH3-].[CH3-].[CH3-].[CH3-].[Zn+2].[Zn+2]
InChIInChI=1S/C2H6O4.4CH3.2Zn/c3-1(4)2(5)6;;;;;;/h1-6H;4*1H3;;/q;4*-1;2*+2
InChIKeyDGXDSDLYDPCAJH-UHFFFAOYSA-N
XLogP-0.60
TPSA80.92 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.99
LogP ≤ 5-0.60
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

hexakis(ethane-1,1,2,2-tetrol);ruthenium;tetrahydrate
CID 58875440
butane-1,1,2,3,4,4-hexol
CID 5238182
carbanylium;copper;ethane-1,1,2,2-tetrol
CID 58811114
CID 6396229
CID 6396229
(2R,3S,4S)-6-methylheptane-1,1,2,3,4-pentol
CID 59876270
2-sulfanylethane-1,1,2-triol
CID 14440976
nickel;tetrahydroxyphosphanium
CID 175076468
hexane-1,1,2,3,4,5,6-heptol
CID 20721397
trihydroxy(phosphanyl)phosphanium
CID 172746758
dioxidanium;bis(N'-(2-aminoethyl)ethane-1,2-diamine);ethane-1,1,2,2-tetrol;nickel
CID 6398134
carbanide;cyclopentane;tris(propan-2-ol);titanium
CID 162281882
carbanide;1,2-difluoroethanol;rutherfordium
CID 58942634

Frequently Asked Questions

What is the IUPAC name of dizinc;carbanide;ethane-1,1,2,2-tetrol?
The IUPAC name of dizinc;carbanide;ethane-1,1,2,2-tetrol (CID 59911813) is dizinc;carbanide;ethane-1,1,2,2-tetrol.
What is the SMILES notation for dizinc;carbanide;ethane-1,1,2,2-tetrol?
The canonical SMILES for dizinc;carbanide;ethane-1,1,2,2-tetrol is OC(O)C(O)O.[CH3-].[CH3-].[CH3-].[CH3-].[Zn+2].[Zn+2].
What is the InChIKey of dizinc;carbanide;ethane-1,1,2,2-tetrol?
The InChIKey is DGXDSDLYDPCAJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H6O4.4CH3.2Zn/c3-1(4)2(5)6;;;;;;/h1-6H;4*1H3;;/q;4*-1;2*+2.
What are the key properties of dizinc;carbanide;ethane-1,1,2,2-tetrol?
dizinc;carbanide;ethane-1,1,2,2-tetrol has a molecular weight of 284.99 g/mol, XLogP of -0.60, 1 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for dizinc;carbanide;ethane-1,1,2,2-tetrol is sourced from PubChem (CID 59911813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).