bis(2-aminoacetic acid);germanium(4+);hydron;(oxygen(2-));tungsten

C4H14GeN2O44W12-72 — CID 86572624

IUPACbis(2-aminoacetic acid);germanium(4+);hydron;(oxygen(2-));tungsten
SMILESNCC(=O)O.NCC(=O)O.[Ge+4].[H+].[H+].[H+].[H+].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W]
InChIInChI=1S/2C2H5NO2.Ge.40O.12W/c2*3-1-2(4)5;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/h2*1,3H2,(H,4,5);;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;+4;40*-2;;;;;;;;;;;;/p+4
InChIKeyAJUTYGGTXHDULQ-UHFFFAOYSA-R
MW3072.82 g/mol
LogP-6.65
Rot. Bonds2

About bis(2-aminoacetic acid);germanium(4+);hydron;(oxygen(2-));tungsten

bis(2-aminoacetic acid);germanium(4+);hydron;(oxygen(2-));tungsten (PubChem CID 86572624) has the molecular formula C4H14GeN2O44W12-72 and a molecular weight of 3072.82 g/mol. Its IUPAC name is bis(2-aminoacetic acid);germanium(4+);hydron;(oxygen(2-));tungsten.

Molecular Properties

Compound Namebis(2-aminoacetic acid);germanium(4+);hydron;(oxygen(2-));tungsten
PubChem CID86572624
Molecular FormulaC4H14GeN2O44W12-72
Molecular Weight3072.82 g/mol
Exact Mass3075.26
IUPAC Namebis(2-aminoacetic acid);germanium(4+);hydron;(oxygen(2-));tungsten
SMILESNCC(=O)O.NCC(=O)O.[Ge+4].[H+].[H+].[H+].[H+].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W]
InChIInChI=1S/2C2H5NO2.Ge.40O.12W/c2*3-1-2(4)5;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/h2*1,3H2,(H,4,5);;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;+4;40*-2;;;;;;;;;;;;/p+4
InChIKeyAJUTYGGTXHDULQ-UHFFFAOYSA-R
XLogP-6.65
TPSA1266.64 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms63
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 5003072.82
LogP ≤ 5-6.65
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of bis(2-aminoacetic acid);germanium(4+);hydron;(oxygen(2-));tungsten?
The IUPAC name of bis(2-aminoacetic acid);germanium(4+);hydron;(oxygen(2-));tungsten (CID 86572624) is bis(2-aminoacetic acid);germanium(4+);hydron;(oxygen(2-));tungsten.
What is the SMILES notation for bis(2-aminoacetic acid);germanium(4+);hydron;(oxygen(2-));tungsten?
The canonical SMILES for bis(2-aminoacetic acid);germanium(4+);hydron;(oxygen(2-));tungsten is NCC(=O)O.NCC(=O)O.[Ge+4].[H+].[H+].[H+].[H+].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].[W].
What is the InChIKey of bis(2-aminoacetic acid);germanium(4+);hydron;(oxygen(2-));tungsten?
The InChIKey is AJUTYGGTXHDULQ-UHFFFAOYSA-R. The full InChI is InChI=1S/2C2H5NO2.Ge.40O.12W/c2*3-1-2(4)5;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/h2*1,3H2,(H,4,5);;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;;/q;;+4;40*-2;;;;;;;;;;;;/p+4.
What are the key properties of bis(2-aminoacetic acid);germanium(4+);hydron;(oxygen(2-));tungsten?
bis(2-aminoacetic acid);germanium(4+);hydron;(oxygen(2-));tungsten has a molecular weight of 3072.82 g/mol, XLogP of -6.65, 2 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-aminoacetic acid);germanium(4+);hydron;(oxygen(2-));tungsten is sourced from PubChem (CID 86572624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).