CID 162639754

H10CaMn4O6 — CID 162639754

IUPAC—
SMILESO.O.O.O.OO.[Ca].[Mn].[Mn].[Mn].[Mn]
InChIInChI=1S/Ca.4Mn.H2O2.4H2O/c;;;;;1-2;;;;/h;;;;;1-2H;4*1H2
InChIKeyHJXBGOCPFQSFGE-UHFFFAOYSA-N
MW365.90 g/mol
LogP-3.67
Rot. Bonds

About CID 162639754

CID 162639754 (PubChem CID 162639754) has the molecular formula H10CaMn4O6 and a molecular weight of 365.90 g/mol.

Molecular Properties

Compound NameCID 162639754
PubChem CID162639754
Molecular FormulaH10CaMn4O6
Molecular Weight365.90 g/mol
Exact Mass365.76
IUPAC Name—
SMILESO.O.O.O.OO.[Ca].[Mn].[Mn].[Mn].[Mn]
InChIInChI=1S/Ca.4Mn.H2O2.4H2O/c;;;;;1-2;;;;/h;;;;;1-2H;4*1H2
InChIKeyHJXBGOCPFQSFGE-UHFFFAOYSA-N
XLogP-3.67
TPSA166.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.90
LogP ≤ 5-3.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

Analyze CID 162639754 with MolForge

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

Launch Full Analysis

Related Compounds

carbonic acid;manganese;hydrate
CID 87309045
cobalt;hydrogen peroxide;manganese
CID 174961556
hydrogen peroxide;uranium;dihydrate
CID 173422908
hydrogen peroxide
CID 21255768
hydrogen peroxide
CID 159255937
barium(2+);hydride;hydrogen peroxide;hydrate
CID 173344510
lithium;hydrogen peroxide;hydroxide;hydrate
CID 86597967
lithium;hydride;hydrogen peroxide;manganese
CID 174681422
manganese;methanol;hydrate
CID 175350190
acetic acid;manganese;tetrahydrate
CID 178069783
acetic acid;manganese;zirconium;tetrahydrate
CID 173164754
magnesium;alumane;carbonic acid;hydride;manganese;trihydrate
CID 173379231

Frequently Asked Questions

What is the IUPAC name of CID 162639754?
The IUPAC name of CID 162639754 (CID 162639754) is not available.
What is the SMILES notation for CID 162639754?
The canonical SMILES for CID 162639754 is O.O.O.O.OO.[Ca].[Mn].[Mn].[Mn].[Mn].
What is the InChIKey of CID 162639754?
The InChIKey is HJXBGOCPFQSFGE-UHFFFAOYSA-N. The full InChI is InChI=1S/Ca.4Mn.H2O2.4H2O/c;;;;;1-2;;;;/h;;;;;1-2H;4*1H2.
What are the key properties of CID 162639754?
CID 162639754 has a molecular weight of 365.90 g/mol, XLogP of -3.67, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 162639754 is sourced from PubChem (CID 162639754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).