alumane;carbonic acid;zinc

CH5AlO3Zn — CID 173015750

IUPACalumane;carbonic acid;zinc
SMILESO=C(O)O.[AlH3].[Zn]
InChIInChI=1S/CH2O3.Al.Zn.3H/c2-1(3)4;;;;;/h(H2,2,3,4);;;;;
InChIKeyGAXJTMWCUAHDAP-UHFFFAOYSA-N
MW157.42 g/mol
LogP-0.96
Rot. Bonds

About alumane;carbonic acid;zinc

alumane;carbonic acid;zinc (PubChem CID 173015750) has the molecular formula CH5AlO3Zn and a molecular weight of 157.42 g/mol. Its IUPAC name is alumane;carbonic acid;zinc.

Molecular Properties

Compound Namealumane;carbonic acid;zinc
PubChem CID173015750
Molecular FormulaCH5AlO3Zn
Molecular Weight157.42 g/mol
Exact Mass155.93
IUPAC Namealumane;carbonic acid;zinc
SMILESO=C(O)O.[AlH3].[Zn]
InChIInChI=1S/CH2O3.Al.Zn.3H/c2-1(3)4;;;;;/h(H2,2,3,4);;;;;
InChIKeyGAXJTMWCUAHDAP-UHFFFAOYSA-N
XLogP-0.96
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.42
LogP ≤ 5-0.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of alumane;carbonic acid;zinc?
The IUPAC name of alumane;carbonic acid;zinc (CID 173015750) is alumane;carbonic acid;zinc.
What is the SMILES notation for alumane;carbonic acid;zinc?
The canonical SMILES for alumane;carbonic acid;zinc is O=C(O)O.[AlH3].[Zn].
What is the InChIKey of alumane;carbonic acid;zinc?
The InChIKey is GAXJTMWCUAHDAP-UHFFFAOYSA-N. The full InChI is InChI=1S/CH2O3.Al.Zn.3H/c2-1(3)4;;;;;/h(H2,2,3,4);;;;;.
What are the key properties of alumane;carbonic acid;zinc?
alumane;carbonic acid;zinc has a molecular weight of 157.42 g/mol, XLogP of -0.96, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for alumane;carbonic acid;zinc is sourced from PubChem (CID 173015750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).