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638-38-0 molecular structure
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manganese(2+) ion diacetate

ChemBase ID: 295894
Molecular Formular: C4H6MnO4
Molecular Mass: 173.026089
Monoisotopic Mass: 172.96465377
SMILES and InChIs

SMILES:
CC(=O)[O-].CC(=O)[O-].[Mn+2]
Canonical SMILES:
[O-]C(=O)C.[O-]C(=O)C.[Mn+2]
InChI:
InChI=1S/2C2H4O2.Mn/c2*1-2(3)4;/h2*1H3,(H,3,4);/q;;+2/p-2
InChIKey:
UOGMEBQRZBEZQT-UHFFFAOYSA-L

Cite this record

CBID:295894 http://www.chembase.cn/molecule-295894.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
manganese(2+) ion diacetate
IUPAC Traditional name
manganese(2+) ion diacetate
Synonyms
Manganese(II) acetate, anhydrous
无水乙酸锰(II)
CAS Number
638-38-0
EC Number
211-334-3
MDL Number
MFCD00013039
Merck Index
145724
PubChem SID
180681425
PubChem CID
12525

DATA SOURCES

DATA SOURCES

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Data Source Data ID
PubChem 12525 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 4.54344  H Acceptors
H Donor LogD (pH = 5.5) -1.2242727 
LogD (pH = 7.4) -2.9968748  Log P -0.22334571 
Molar Refractivity 23.4808 cm3 Polarizability 4.912116 Å3
Polar Surface Area 40.13 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Safety Information Product Information Bioassay(PubChem)
Storage Warning
Hygroscopic expand Show data source
RTECS
AI5770000 expand Show data source
European Hazard Symbols
Irritant Irritant (Xi) expand Show data source
Risk Statements
36/37/38 expand Show data source
Safety Statements
26-37 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS07 expand Show data source
GHS Hazard statements
H315-H319-H335 expand Show data source
GHS Precautionary statements
P261-P305+P351+P338-P302+P352-P321-P405-P501A expand Show data source
Purity
98+% expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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