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15442-57-6 molecular structure
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bis((ethylsulfanyl)ethane); dichloroplatinum

ChemBase ID: 140266
Molecular Formular: C8H20Cl2PtS2
Molecular Mass: 446.3584
Monoisotopic Mass: 445.003139
SMILES and InChIs

SMILES:
CCSCC.CCSCC.Cl[Pt]Cl
Canonical SMILES:
CCSCC.CCSCC.Cl[Pt]Cl
InChI:
InChI=1S/2C4H10S.2ClH.Pt/c2*1-3-5-4-2;;;/h2*3-4H2,1-2H3;2*1H;/q;;;;+2/p-2
InChIKey:
DCIVLRIRJUWCIS-UHFFFAOYSA-L

Cite this record

CBID:140266 http://www.chembase.cn/molecule-140266.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
bis((ethylsulfanyl)ethane); dichloroplatinum
IUPAC Traditional name
bis(ethyl sulfide); platinum(II) chloride
Synonyms
cis-Dichlorobis(1,1′-thiobisethane)platinum
cis-Bis(diethyl sulfide)platinum(II) chloride
cis-Dichlorobis(diethyl sulfide)platinum(II)
顺-二(二乙基硫醚)二氯化铂(II)
顺-二氯二(二乙基硫醚)铂(II)
CAS Number
15442-57-6
EC Number
239-454-1
MDL Number
MFCD00050943
PubChem SID
24867101
162234510
PubChem CID
167183

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Sigma Aldrich
432849 external link Add to cart Please log in.
Data Source Data ID
PubChem 167183 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 1.7296395  LogD (pH = 7.4) 1.7296395 
Log P 1.7296395  Molar Refractivity 28.4873 cm3
Polarizability 11.173222 Å3 Polar Surface Area 0.0 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Melting Point
105 °C(lit.) expand Show data source
European Hazard Symbols
Irritant Irritant (Xi) expand Show data source
MSDS Link
Download expand Show data source
German water hazard class
3 expand Show data source
Risk Statements
36/37/38 expand Show data source
Safety Statements
26-36 expand Show data source
GHS Pictograms
GHS07 expand Show data source
GHS Signal Word
Warning expand Show data source
GHS Hazard statements
H315-H319-H335 expand Show data source
GHS Precautionary statements
P261-P305 + P351 + P338 expand Show data source
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves expand Show data source
Linear Formula
[(C2H5)2S]2PtCl2 expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 432849 external link
Packaging
1 g in glass bottle

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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