Al2 (Mo3 O12)

Al4Mo6 — CID 139045823

IUPAC
SMILES[Al].[Al].[Al].[Al].[Mo].[Mo].[Mo].[Mo].[Mo].[Mo]
InChIInChI=1S/4Al.6Mo
InChIKeyPQSJZVVABCBGHQ-UHFFFAOYSA-N
MW683.57 g/mol
LogP-1.54
Rot. Bonds

About Al2 (Mo3 O12)

Al2 (Mo3 O12) (PubChem CID 139045823) has the molecular formula Al4Mo6 and a molecular weight of 683.57 g/mol.

Molecular Properties

Compound NameAl2 (Mo3 O12)
PubChem CID139045823
Molecular FormulaAl4Mo6
Molecular Weight683.57 g/mol
Exact Mass695.36
IUPAC Name
SMILES[Al].[Al].[Al].[Al].[Mo].[Mo].[Mo].[Mo].[Mo].[Mo]
InChIInChI=1S/4Al.6Mo
InChIKeyPQSJZVVABCBGHQ-UHFFFAOYSA-N
XLogP-1.54
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500683.57
LogP ≤ 5-1.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze Al2 (Mo3 O12) with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of Al2 (Mo3 O12)?
The IUPAC name of Al2 (Mo3 O12) (CID 139045823) is not available.
What is the SMILES notation for Al2 (Mo3 O12)?
The canonical SMILES for Al2 (Mo3 O12) is [Al].[Al].[Al].[Al].[Mo].[Mo].[Mo].[Mo].[Mo].[Mo].
What is the InChIKey of Al2 (Mo3 O12)?
The InChIKey is PQSJZVVABCBGHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/4Al.6Mo.
What are the key properties of Al2 (Mo3 O12)?
Al2 (Mo3 O12) has a molecular weight of 683.57 g/mol, XLogP of -1.54, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for Al2 (Mo3 O12) is sourced from PubChem (CID 139045823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).