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3970-13-6,MFCD02093436
Catalog No.:AA003O19

3970-13-6 | Benzyl chloromethyl sulfide

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
>96.0%(GC)
in stock  
$53.00   $37.00
- +
25g
>96.0%(GC)
in stock  
$261.00   $183.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA003O19
Chemical Name:
Benzyl chloromethyl sulfide
CAS Number:
3970-13-6
Molecular Formula:
C8H9ClS
Molecular Weight:
172.6751
MDL Number:
MFCD02093436
SMILES:
ClCSCc1ccccc1
NSC Number:
266050
Properties
Properties
 
BP:
233.9°C at 760 mmHg  
Refractive Index:
1.5780-1.5820  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
79.3  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
3.1  

Downstream Synthesis Route
56-89-3    3970-13-6   
S-Benzylthiomethyl-L-cystein 

[1]JournaloftheChemicalSociety,1964,p.3832-3840

54326-16-8    3970-13-6   
1-(benzylthio)methyl-5-chloro-2(1H)-pyrimidinone 

[1]EuropeanJournalofMedicinalChemistry,1993,vol.28,p.463-472

[1]Ito;Ota;Suhara;Tabashi;Kawashima[ChemicalandPharmaceuticalBulletin,1993,vol.41,#6,p.1066-1073]

Literature
Quotation Request
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SDS
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Tags:3970-13-6 Molecular Formula|3970-13-6 MDL|3970-13-6 SMILES|3970-13-6 Benzyl chloromethyl sulfide
Catalog No.: AA003O19
3970-13-6,MFCD02093436
3970-13-6 | Benzyl chloromethyl sulfide
Pack Size： 5g
Purity： >96.0%(GC)
in stock
$53.00 $37.00
Pack Size： 25g
Purity： >96.0%(GC)
in stock
$261.00 $183.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA003O19
Chemical Name: Benzyl chloromethyl sulfide
CAS Number: 3970-13-6
Molecular Formula: C8H9ClS
Molecular Weight: 172.6751
MDL Number: MFCD02093436
SMILES: ClCSCc1ccccc1
NSC Number: 266050
Properties
BP: 233.9°C at 760 mmHg  
Refractive Index: 1.5780-1.5820  
Storage: Keep in dry area;2-8℃;  
Complexity: 79.3  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 10  
Hydrogen Bond Acceptor Count: 1  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 3.1  
Downstream Synthesis Route
56-89-3    3970-13-6   
S-Benzylthiomethyl-L-cystein 

[1]JournaloftheChemicalSociety,1964,p.3832-3840

54326-16-8    3970-13-6   
1-(benzylthio)methyl-5-chloro-2(1H)-pyrimidinone 

[1]EuropeanJournalofMedicinalChemistry,1993,vol.28,p.463-472

816-11-5    3970-13-6    153893-83-5 

[1]Ito;Ota;Suhara;Tabashi;Kawashima[ChemicalandPharmaceuticalBulletin,1993,vol.41,#6,p.1066-1073]

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