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13965-31-6 molecular structure
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2-(pyridin-2-yl)pyridine; dichloroplatinum

ChemBase ID: 148062
Molecular Formular: C10H8Cl2N2Pt
Molecular Mass: 422.16792
Monoisotopic Mass: 420.97124463
SMILES and InChIs

SMILES:
c1ccnc(c1)c1ccccn1.Cl[Pt]Cl
Canonical SMILES:
c1ccc(nc1)c1ccccn1.Cl[Pt]Cl
InChI:
InChI=1S/C10H8N2.2ClH.Pt/c1-3-7-11-9(5-1)10-6-2-4-8-12-10;;;/h1-8H;2*1H;/q;;;+2/p-2
InChIKey:
YVQNEQKKLNWXEM-UHFFFAOYSA-L

Cite this record

CBID:148062 http://www.chembase.cn/molecule-148062.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
2-(pyridin-2-yl)pyridine; dichloroplatinum
IUPAC Traditional name
bipyridyl; platinum(II) chloride
Synonyms
Dichloro(2,2′-bipyridine)platinum
Dichloro(bipyridine)platinum
(2,2′-Bipyridine)dichloroplatinum(II)
(2,2′-联吡啶)二氯化铂(II)
CAS Number
13965-31-6
MDL Number
MFCD00191790
PubChem SID
162242241
24865030
PubChem CID
6099922

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Sigma Aldrich
401609 external link Add to cart Please log in.
Data Source Data ID
PubChem 6099922 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 1.9542185  LogD (pH = 7.4) 1.956794 
Log P 1.9568269  Molar Refractivity 46.1364 cm3
Polarizability 19.578226 Å3 Polar Surface Area 25.78 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Melting Point
>300 °C(lit.) expand Show data source
European Hazard Symbols
Harmful Harmful (Xn) expand Show data source
MSDS Link
Download expand Show data source
German water hazard class
3 expand Show data source
Risk Statements
20/21/22-36/37/38 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
H302-H312-H315-H319-H332-H335 expand Show data source
GHS Precautionary statements
P261-P280-P305 + P351 + P338 expand Show data source
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves expand Show data source
Purity
96% expand Show data source
Empirical Formula (Hill Notation)
C10H8Cl2N2Pt expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 401609 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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