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133113-76-5,MFCD20265584
Catalog No.:AA00146W

133113-76-5 | Dimethyl 2-(1,3-dithiole)phosphonate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
>97.0%(GC)
in stock  
$402.00   $281.00
- +
5g
>97.0%(GC)
in stock  
$1,395.00   $976.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00146W
Chemical Name:
Dimethyl 2-(1,3-dithiole)phosphonate
CAS Number:
133113-76-5
Molecular Formula:
C5H9O3PS2
Molecular Weight:
212.2269
MDL Number:
MFCD20265584
SMILES:
COP(=O)(C1SC=CS1)OC
Properties
Properties
 
Form:
Liquid  
Refractive Index:
1.5590-1.5630  
Storage:
-20 ℃;  

Computed Properties
 
Complexity:
190  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
0.8  

Downstream Synthesis Route

[1]JournaloftheChemicalSociety.Chemicalcommunications,1992,p.1137-1138

[2]JournalofOrganicChemistry,1994,vol.59,p.442-450

25796-72-9    133113-76-5   
7-(1,3-Dithiol-2-ylidene)-7H-cyclopenta<1,2-b;4,3-b'>dithiophene 

[1]Kozaki,Masatoshi;Tanaka,Shoji;Yamashita,Yoshiro[ChemistryLetters,1993,#3,p.533-536]

3163-76-6    133113-76-5   
1,3,5-tris(1,4-dithiafulven-6-yl)benzene 

[1]JournaloftheAmericanChemicalSociety,1993,vol.115,p.3752-3759

3029-32-1    133113-76-5   
C28H16S4 

[1]JournalofOrganicChemistry,1998,vol.63,p.1268-1279

4430-15-3    133113-76-5   
C36H18S6 

[1]Perez,EmilioM.;Sierra,Maria;Sanchez,Luis;Torres,M.Rosario;Viruela,Rafael;Viruela,PedroM.;Orti,Enrique;Martin,Nazario[AngewandteChemie-InternationalEdition,2007,vol.46,#11,p.1847-1851]

Literature
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SDS
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1032504-39-4
Tags:133113-76-5 Molecular Formula|133113-76-5 MDL|133113-76-5 SMILES|133113-76-5 Dimethyl 2-(1,3-dithiole)phosphonate
Catalog No.: AA00146W
133113-76-5,MFCD20265584
133113-76-5 | Dimethyl 2-(1,3-dithiole)phosphonate
Pack Size： 1g
Purity： >97.0%(GC)
in stock
$402.00 $281.00
Pack Size： 5g
Purity： >97.0%(GC)
in stock
$1,395.00 $976.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00146W
Chemical Name: Dimethyl 2-(1,3-dithiole)phosphonate
CAS Number: 133113-76-5
Molecular Formula: C5H9O3PS2
Molecular Weight: 212.2269
MDL Number: MFCD20265584
SMILES: COP(=O)(C1SC=CS1)OC
Properties
Form: Liquid  
Refractive Index: 1.5590-1.5630  
Storage: -20 ℃;  
Complexity: 190  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 11  
Hydrogen Bond Acceptor Count: 5  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 0.8  
Downstream Synthesis Route
25796-77-4    133113-76-5    143693-14-5 

[1]JournaloftheChemicalSociety.Chemicalcommunications,1992,p.1137-1138

[2]JournalofOrganicChemistry,1994,vol.59,p.442-450

25796-72-9    133113-76-5   
7-(1,3-Dithiol-2-ylidene)-7H-cyclopenta<1,2-b;4,3-b'>dithiophene 

[1]Kozaki,Masatoshi;Tanaka,Shoji;Yamashita,Yoshiro[ChemistryLetters,1993,#3,p.533-536]

3163-76-6    133113-76-5   
1,3,5-tris(1,4-dithiafulven-6-yl)benzene 

[1]JournaloftheAmericanChemicalSociety,1993,vol.115,p.3752-3759

3029-32-1    133113-76-5   
C28H16S4 

[1]JournalofOrganicChemistry,1998,vol.63,p.1268-1279

4430-15-3    133113-76-5   
C36H18S6 

[1]Perez,EmilioM.;Sierra,Maria;Sanchez,Luis;Torres,M.Rosario;Viruela,Rafael;Viruela,PedroM.;Orti,Enrique;Martin,Nazario[AngewandteChemie-InternationalEdition,2007,vol.46,#11,p.1847-1851]

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