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335104-84-2,MFCD11840613
Catalog No.:AA00BYAG

335104-84-2 | 2-(2-Chloro-4-(methylsulfonyl)-3-((2,2,2-trifluoroethoxy)methyl)benzoyl)cyclohexane-1,3-dione

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$106.00   $74.00
- +
1g
95%
in stock  
$970.00   $679.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00BYAG
Chemical Name:
2-(2-Chloro-4-(methylsulfonyl)-3-((2,2,2-trifluoroethoxy)methyl)benzoyl)cyclohexane-1,3-dione
CAS Number:
335104-84-2
Molecular Formula:
C17H16ClF3O6S
Molecular Weight:
440.8185
MDL Number:
MFCD11840613
SMILES:
O=C1CCCC(=O)C1C(=O)c1ccc(c(c1Cl)COCC(F)(F)F)S(=O)(=O)C
Properties
Computed Properties
 
Complexity:
714  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
9  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
6  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.2  

Downstream Synthesis Route
2-chloro-3-methyl-4-(methylsulfonyl)benzoicacidmethylester 
  335104-84-2 

[1]CurrentPatentAssignee:WUHANINSTITUTEOFTECHNOLOGY-CN104292137,2016,B

[2]CurrentPatentAssignee:ZHEJIANGZHONGSHANCHEMINDGROUP-CN109678767,2019,A

2-chloro-3-(2,2,2-trifluoroethoxy)methyl-4-methanesulfonylbenzoicacid3-oxo-1-cyclohexenylester 
  335104-84-2 

[1]CurrentPatentAssignee:WUHANINSTITUTEOFTECHNOLOGY-CN104292137,2016,BLocationinpatent:Paragraph0058-0060

[2]CurrentPatentAssignee:SINOCHEMHOLDINGSCORPORATIONLTD;JIANGSUYANGNONGCHEMICALCO.,LTD.-CN113845451,2021,ALocationinpatent:Paragraph0096;0103-0104

[1]CurrentPatentAssignee:WUHANINSTITUTEOFTECHNOLOGY-CN104292137,2016,B

[1]CurrentPatentAssignee:WUHANINSTITUTEOFTECHNOLOGY-CN104292137,2016,B

Literature

Title: Resistance to HPPD-inhibiting herbicides in a population of waterhemp (Amaranthus tuberculatus) from Illinois, United States.

Journal: Pest management science 20110301

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SDS
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Tags:335104-84-2 Molecular Formula|335104-84-2 MDL|335104-84-2 SMILES|335104-84-2 2-(2-Chloro-4-(methylsulfonyl)-3-((2,2,2-trifluoroethoxy)methyl)benzoyl)cyclohexane-1,3-dione
Catalog No.: AA00BYAG
335104-84-2,MFCD11840613
335104-84-2 | 2-(2-Chloro-4-(methylsulfonyl)-3-((2,2,2-trifluoroethoxy)methyl)benzoyl)cyclohexane-1,3-dione
Pack Size： 100mg
Purity： 95%
in stock
$106.00 $74.00
Pack Size： 1g
Purity： 95%
in stock
$970.00 $679.00
Quantity
- +
Add to Card
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Technical Information
Catalog Number: AA00BYAG
Chemical Name: 2-(2-Chloro-4-(methylsulfonyl)-3-((2,2,2-trifluoroethoxy)methyl)benzoyl)cyclohexane-1,3-dione
CAS Number: 335104-84-2
Molecular Formula: C17H16ClF3O6S
Molecular Weight: 440.8185
MDL Number: MFCD11840613
SMILES: O=C1CCCC(=O)C1C(=O)c1ccc(c(c1Cl)COCC(F)(F)F)S(=O)(=O)C
Properties
Complexity: 714  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 28  
Hydrogen Bond Acceptor Count: 9  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 6  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.2  
Downstream Synthesis Route
2-chloro-3-methyl-4-(methylsulfonyl)benzoicacidmethylester 
  335104-84-2 

[1]CurrentPatentAssignee:WUHANINSTITUTEOFTECHNOLOGY-CN104292137,2016,B

[2]CurrentPatentAssignee:ZHEJIANGZHONGSHANCHEMINDGROUP-CN109678767,2019,A

2-chloro-3-(2,2,2-trifluoroethoxy)methyl-4-methanesulfonylbenzoicacid3-oxo-1-cyclohexenylester 
  335104-84-2 

[1]CurrentPatentAssignee:WUHANINSTITUTEOFTECHNOLOGY-CN104292137,2016,BLocationinpatent:Paragraph0058-0060

[2]CurrentPatentAssignee:SINOCHEMHOLDINGSCORPORATIONLTD;JIANGSUYANGNONGCHEMICALCO.,LTD.-CN113845451,2021,ALocationinpatent:Paragraph0096;0103-0104

95-49-8    335104-84-2 

[1]CurrentPatentAssignee:WUHANINSTITUTEOFTECHNOLOGY-CN104292137,2016,B

82961-57-7    335104-84-2 

[1]CurrentPatentAssignee:WUHANINSTITUTEOFTECHNOLOGY-CN104292137,2016,B

Literature fold

Title: Resistance to HPPD-inhibiting herbicides in a population of waterhemp (Amaranthus tuberculatus) from Illinois, United States.

Journal: Pest management science20110301

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