CID 71345932

CHAlCuO4- — CID 71345932

IUPAC
SMILESO=C([O-])[O-].[Al].[Cu+2].[OH-]
InChIInChI=1S/CH2O3.Al.Cu.H2O/c2-1(3)4;;;/h(H2,2,3,4);;;1H2/q;;+2;/p-3
InChIKeySWCUHSKNFHAQSU-UHFFFAOYSA-K
MW167.54 g/mol
LogP-3.01
Rot. Bonds

About CID 71345932

CID 71345932 (PubChem CID 71345932) has the molecular formula CHAlCuO4- and a molecular weight of 167.54 g/mol.

Molecular Properties

Compound NameCID 71345932
PubChem CID71345932
Molecular FormulaCHAlCuO4-
Molecular Weight167.54 g/mol
Exact Mass166.90
IUPAC Name
SMILESO=C([O-])[O-].[Al].[Cu+2].[OH-]
InChIInChI=1S/CH2O3.Al.Cu.H2O/c2-1(3)4;;;/h(H2,2,3,4);;;1H2/q;;+2;/p-3
InChIKeySWCUHSKNFHAQSU-UHFFFAOYSA-K
XLogP-3.01
TPSA93.19 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms7
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.54
LogP ≤ 5-3.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of CID 71345932?
The IUPAC name of CID 71345932 (CID 71345932) is not available.
What is the SMILES notation for CID 71345932?
The canonical SMILES for CID 71345932 is O=C([O-])[O-].[Al].[Cu+2].[OH-].
What is the InChIKey of CID 71345932?
The InChIKey is SWCUHSKNFHAQSU-UHFFFAOYSA-K. The full InChI is InChI=1S/CH2O3.Al.Cu.H2O/c2-1(3)4;;;/h(H2,2,3,4);;;1H2/q;;+2;/p-3.
What are the key properties of CID 71345932?
CID 71345932 has a molecular weight of 167.54 g/mol, XLogP of -3.01, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 71345932 is sourced from PubChem (CID 71345932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).