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50528-86-4,MFCD00037029
Catalog No.:AA006YG4

50528-86-4 | 1-Chloro-2-isocyanato-4-(trifluoromethyl)benzene

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
97%
in stock  
$20.00   $14.00
- +
5g
97%
in stock  
$95.00   $67.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA006YG4
Chemical Name:
1-Chloro-2-isocyanato-4-(trifluoromethyl)benzene
CAS Number:
50528-86-4
Molecular Formula:
C8H3ClF3NO
Molecular Weight:
221.5637
MDL Number:
MFCD00037029
SMILES:
O=C=Nc1cc(ccc1Cl)C(F)(F)F
Properties
Computed Properties
 
Complexity:
250  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
4.2  

Downstream Synthesis Route

[1]Patent:US2745874,1954,

[1]Patent:DE2004302,1970,    Chem.Abstr.,1970,vol.73

[2]Patent:US3721699,1973,    Chem.Abstr.,1973,vol.78

[1]Patent:FR1531794,1968,    Chem.Abstr.,1969,vol.71

[1]Patent:DE2041986,1971,    Chem.Abstr.,1971,vol.75

15761-38-3    50528-86-4    161956-90-7   
(S)-3-(2-Chloro-5-trifluoromethyl-phenyl)-5-methyl-1-(1,2,3,4-tetrahydro-naphthalen-1-yl)-imidazolidine-2,4-dione 

[1]TetrahedronLetters,1998,vol.39,p.9469-9472

Literature
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SDS
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Tags:50528-86-4 Molecular Formula|50528-86-4 MDL|50528-86-4 SMILES|50528-86-4 1-Chloro-2-isocyanato-4-(trifluoromethyl)benzene
Catalog No.: AA006YG4
50528-86-4,MFCD00037029
50528-86-4 | 1-Chloro-2-isocyanato-4-(trifluoromethyl)benzene
Pack Size： 1g
Purity： 97%
in stock
$20.00 $14.00
Pack Size： 5g
Purity： 97%
in stock
$95.00 $67.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA006YG4
Chemical Name: 1-Chloro-2-isocyanato-4-(trifluoromethyl)benzene
CAS Number: 50528-86-4
Molecular Formula: C8H3ClF3NO
Molecular Weight: 221.5637
MDL Number: MFCD00037029
SMILES: O=C=Nc1cc(ccc1Cl)C(F)(F)F
Properties
Complexity: 250  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 14  
Hydrogen Bond Acceptor Count: 5  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 4.2  
Downstream Synthesis Route
50528-86-4    95-76-1    584-81-6 

[1]Patent:US2745874,1954,

50528-86-4    50903-32-7    28396-13-6 

[1]Patent:DE2004302,1970,    Chem.Abstr.,1970,vol.73

[2]Patent:US3721699,1973,    Chem.Abstr.,1973,vol.78

50528-86-4    13683-89-1    23122-52-3 

[1]Patent:FR1531794,1968,    Chem.Abstr.,1969,vol.71

50528-86-4    107-19-7    32496-42-7 

[1]Patent:DE2041986,1971,    Chem.Abstr.,1971,vol.75

15761-38-3    50528-86-4    161956-90-7   
(S)-3-(2-Chloro-5-trifluoromethyl-phenyl)-5-methyl-1-(1,2,3,4-tetrahydro-naphthalen-1-yl)-imidazolidine-2,4-dione 

[1]TetrahedronLetters,1998,vol.39,p.9469-9472

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