Benzene,1,1'-[1,2-e...

Benzene,1,1'-[1,2-ethanediylbis(thio)]bis[4-chloro- (9CI) 5409-87-0

Benzene,1,1'-[1,2-ethanediylbis(thio)]bis[4-chloro- (9CI) 5409-87-0

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1 Kilogram

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  • Min.Order :1 Kilogram
  • Purity: 99%
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Benzene,1,1'-[1,2-ethanediylbis(thio)]bis[4-chloro- (9CI) 5409-87-0 98%

Quick Details

  • Appearance:Solid
  • Application:Organic Chemicals
  • PackAge:as requested
  • ProductionCapacity:100|Kilogram|Month
  • Storage:room temperature
  • Transportation:as requested

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Details:

Identification and Related Records
【Name】
Benzene,1,1'-[1,2-ethanediylbis(thio)]bis[4-chloro- (9CI)
【CAS Registry number】
5409-87-0
【Synonyms】
Ethane,1,2-bis[(p-chlorophenyl)thio]- (6CI,7CI,8CI)
1,2-Bis(4-chlorophenylthio)ethane
NSC 12540
【Molecular Formula】
C14H12 Cl2 S2 (Products with the same molecular formula)
【Molecular Weight】
315.2811
【Inchi】
InChI=1/C14H12Cl2S2/c15-11-1-5-13(6-2-11)17-9-10-18-14-7-3-12(16)4-8-14/h1-8H,9-10H2
【Canonical SMILES】
C1=CC(=CC=C1SCCSC2=CC=C(C=C2)Cl)Cl
Chemical and Physical Properties
【Density】
1.35g/cm3
【Boiling Point】
433.1°Cat760mmHg
【Refractive Index】
1.662
【Flash Point】
198.8°C
【Computed Properties】
Molecular Weight:315.28108 [g/mol]
Molecular Formula:C14H12Cl2S2
XLogP3-AA:5.9
H-Bond Donor:0
H-Bond Acceptor:2
Rotatable Bond Count:5
Exact Mass:313.975747
MonoIsotopic Mass:313.975747
Topological Polar Surface Area:50.6
Heavy Atom Count:18
Formal Charge:0
Complexity:198
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Hydrophobe Count:1
Feature 3D Ring Count:2
Effective Rotor Count:5
Conformer Sampling RMSD:0.6
CID Conformer Count:118

 

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