3019-20-3,MFCD00039842
Catalog No.:AA003R2M

3019-20-3 | Isopropylthiobenzene

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
95%
in stock  
$27.00   $19.00
- +
25g
95%
in stock  
$51.00   $36.00
- +
100g
95%
in stock  
$107.00 $75.00
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA003R2M
Chemical Name:
Isopropylthiobenzene
CAS Number:
3019-20-3
Molecular Formula:
C9H12S
Molecular Weight:
152.2566
MDL Number:
MFCD00039842
SMILES:
CC(Sc1ccccc1)C
Properties
Properties
 
BP:
208.0°C  
Form:
Liquid  
MP:
-45°C (estimate)  
Refractive Index:
1.5465  
Stability:
Stench  
Storage:
Room Temperature;  

Computed Properties
 
Complexity:
82.7  
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:
2  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
3.5  

Literature

Title: Iron-catalyzed oxidation of thioethers by iodosylarenes: stereoselectivity and reaction mechanism.

Journal: Chemistry (Weinheim an der Bergstrasse, Germany) 20070101

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SDS
Tags:3019-20-3 Molecular Formula|3019-20-3 MDL|3019-20-3 SMILES|3019-20-3 Isopropylthiobenzene
Catalog No.: AA003R2M
3019-20-3,MFCD00039842
3019-20-3 | Isopropylthiobenzene
Pack Size: 5g
Purity: 95%
in stock
$27.00 $19.00
Pack Size: 25g
Purity: 95%
in stock
$51.00 $36.00
Pack Size: 100g
Purity: 95%
in stock
$107.00 $75.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA003R2M
Chemical Name: Isopropylthiobenzene
CAS Number: 3019-20-3
Molecular Formula: C9H12S
Molecular Weight: 152.2566
MDL Number: MFCD00039842
SMILES: CC(Sc1ccccc1)C
Properties
BP: 208.0°C  
Form: Liquid  
MP: -45°C (estimate)  
Refractive Index: 1.5465  
Stability: Stench  
Storage: Room Temperature;  
Complexity: 82.7  
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: 2  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 3.5  
Literature fold

Title: Iron-catalyzed oxidation of thioethers by iodosylarenes: stereoselectivity and reaction mechanism.

Journal: Chemistry (Weinheim an der Bergstrasse, Germany)20070101

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