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1332-65-6 molecular structure
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tris(copperdiol); dichlorocopper

ChemBase ID: 107481
Molecular Formular: Cl2Cu4H6O6
Molecular Mass: 427.13404
Monoisotopic Mass: 423.67253327
SMILES and InChIs

SMILES:
O[Cu]O.O[Cu]O.O[Cu]O.Cl[Cu]Cl
Canonical SMILES:
O[Cu]O.O[Cu]O.O[Cu]O.Cl[Cu]Cl
InChI:
InChI=1S/2ClH.4Cu.6H2O/h2*1H;;;;;6*1H2/q;;4*+2;;;;;;/p-8
InChIKey:
JNPOSJBMZIQEKM-UHFFFAOYSA-F

Cite this record

CBID:107481 http://www.chembase.cn/molecule-107481.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
tris(copperdiol); dichlorocopper
IUPAC Traditional name
copper chloride; tris(copperdiol)
Synonyms
CUPRIC OXYCHLORIDE
CAS Number
1332-65-6
PubChem SID
162093703
PubChem CID
44135802

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
MP Biomedicals
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Data Source Data ID
PubChem 44135802 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 15.8991165  H Acceptors
H Donor LogD (pH = 5.5) -1.8224 
LogD (pH = 7.4) -1.8224  Log P -1.8224 
Molar Refractivity 5.1292 cm3 Polarizability 5.6817307 Å3
Polar Surface Area 40.46 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Safety Information Product Information Bioassay(PubChem)
MSDS Link
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Certificate of Analysis
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DETAILS

DETAILS

MP Biomedicals MP Biomedicals
MP Biomedicals - 05203911 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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