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12053-18-8 molecular structure
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oxo[(oxochromio)oxy]chromium; bis(oxocopper)

ChemBase ID: 109127
Molecular Formular: Cr2Cu2O5
Molecular Mass: 311.0812
Monoisotopic Mass: 309.7147831
SMILES and InChIs

SMILES:
O=[Cu].O=[Cu].O=[Cr]O[Cr]=O
Canonical SMILES:
O=[Cr]O[Cr]=O.[Cu]=O.[Cu]=O
InChI:
InChI=1S/2Cr.2Cu.5O
InChIKey:
JGDFBJMWFLXCLJ-UHFFFAOYSA-N

Cite this record

CBID:109127 http://www.chembase.cn/molecule-109127.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
oxo[(oxochromio)oxy]chromium; bis(oxocopper)
IUPAC Traditional name
chromia; bis(copper(II) oxide)
Synonyms
COPPER CHROMITE CATALYST
oxo-(oxochromiooxy)chromium
Copper chromite
CAS Number
12053-18-8
EC Number
235-000-1
PubChem SID
162096086
PubChem CID
3084101
Wikipedia Title
Copper_chromite

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
MP Biomedicals
05209937 external link Add to cart Please log in.

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -1.3316  LogD (pH = 7.4) -1.3316 
Log P -1.3316  Molar Refractivity 4.236 cm3
Polarizability 8.424691 Å3 Polar Surface Area 43.37 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Safety Information Product Information Bioassay(PubChem)
European Hazard Symbols
Nature polluting Nature polluting (N) expand Show data source
Harmful Harmful (Xn) expand Show data source
MSDS Link
Download expand Show data source
Risk Statements
R:22-58 expand Show data source
Safety Statements
R expand Show data source
S:36/37/39-61 expand Show data source
Certificate of Analysis
Download expand Show data source

DETAILS

DETAILS

MP Biomedicals MP Biomedicals Wikipedia Wikipedia
MP Biomedicals - 05209937 external link
MP Biomedicals Rare Chemical collection

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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