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1184-64-1 molecular structure
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copper(2+) ion carbonate

ChemBase ID: 126700
Molecular Formular: CCuO3
Molecular Mass: 123.5549
Monoisotopic Mass: 122.91434136
SMILES and InChIs

SMILES:
[Cu+2].[O-]C(=O)[O-]
Canonical SMILES:
[O-]C(=O)[O-].[Cu+2]
InChI:
InChI=1S/CH2O3.Cu/c2-1(3)4;/h(H2,2,3,4);/q;+2/p-2
InChIKey:
GEZOTWYUIKXWOA-UHFFFAOYSA-L

Cite this record

CBID:126700 http://www.chembase.cn/molecule-126700.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
copper(2+) ion carbonate
IUPAC Traditional name
copper(2+) ion carbonate
Synonyms
copper carbonate
cupric carbonate
basic copper carbonate
Copper(II) carbonate
CAS Number
1184-64-1
PubChem SID
162221028
PubChem CID
14452
Chemspider ID
13799
Wikipedia Title
Copper(II)_carbonate

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 6.0525417  H Acceptors
H Donor LogD (pH = 5.5) 0.142811 
LogD (pH = 7.4) -1.1138874  Log P 0.25005138 
Molar Refractivity 31.1724 cm3 Polarizability 3.6386902 Å3
Polar Surface Area 63.19 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Bioassay(PubChem)
Solubility
insoluble in water expand Show data source
soluble in acetic acid expand Show data source
Apperance
green powder expand Show data source
Melting Point
200 °C expand Show data source
Boiling Point
decomposes at 290 °C expand Show data source
Density
3.9 g/cm3 expand Show data source
Std enthalpy of formation
-595 kJ·mol-1 expand Show data source
Std molar entropy
88 J·mol-1·K-1 expand Show data source
RTECS
FF950000 expand Show data source
LD50
159 mg/kg (rat, oral) expand Show data source

DETAILS

DETAILS

Wikipedia Wikipedia

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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