alumane;2-aminoacetic acid;zirconium;trihydrochloride

C2H11AlCl3NO2Zr — CID 173019361

IUPACalumane;2-aminoacetic acid;zirconium;trihydrochloride
SMILESCl.Cl.Cl.NCC(=O)O.[AlH3].[Zr]
InChIInChI=1S/C2H5NO2.Al.3ClH.Zr.3H/c3-1-2(4)5;;;;;;;;/h1,3H2,(H,4,5);;3*1H;;;;
InChIKeyKNHSAXQYDNNQPK-UHFFFAOYSA-N
MW305.68 g/mol
LogP-0.89
Rot. Bonds1

About alumane;2-aminoacetic acid;zirconium;trihydrochloride

alumane;2-aminoacetic acid;zirconium;trihydrochloride (PubChem CID 173019361) has the molecular formula C2H11AlCl3NO2Zr and a molecular weight of 305.68 g/mol. Its IUPAC name is alumane;2-aminoacetic acid;zirconium;trihydrochloride.

Molecular Properties

Compound Namealumane;2-aminoacetic acid;zirconium;trihydrochloride
PubChem CID173019361
Molecular FormulaC2H11AlCl3NO2Zr
Molecular Weight305.68 g/mol
Exact Mass302.87
IUPAC Namealumane;2-aminoacetic acid;zirconium;trihydrochloride
SMILESCl.Cl.Cl.NCC(=O)O.[AlH3].[Zr]
InChIInChI=1S/C2H5NO2.Al.3ClH.Zr.3H/c3-1-2(4)5;;;;;;;;/h1,3H2,(H,4,5);;3*1H;;;;
InChIKeyKNHSAXQYDNNQPK-UHFFFAOYSA-N
XLogP-0.89
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.68
LogP ≤ 5-0.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 174491455

Frequently Asked Questions

What is the IUPAC name of alumane;2-aminoacetic acid;zirconium;trihydrochloride?
The IUPAC name of alumane;2-aminoacetic acid;zirconium;trihydrochloride (CID 173019361) is alumane;2-aminoacetic acid;zirconium;trihydrochloride.
What is the SMILES notation for alumane;2-aminoacetic acid;zirconium;trihydrochloride?
The canonical SMILES for alumane;2-aminoacetic acid;zirconium;trihydrochloride is Cl.Cl.Cl.NCC(=O)O.[AlH3].[Zr].
What is the InChIKey of alumane;2-aminoacetic acid;zirconium;trihydrochloride?
The InChIKey is KNHSAXQYDNNQPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H5NO2.Al.3ClH.Zr.3H/c3-1-2(4)5;;;;;;;;/h1,3H2,(H,4,5);;3*1H;;;;.
What are the key properties of alumane;2-aminoacetic acid;zirconium;trihydrochloride?
alumane;2-aminoacetic acid;zirconium;trihydrochloride has a molecular weight of 305.68 g/mol, XLogP of -0.89, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for alumane;2-aminoacetic acid;zirconium;trihydrochloride is sourced from PubChem (CID 173019361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).