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66411-17-4,MFCD09264171
Catalog No.:AA006M31

66411-17-4 | 6,7-Dibromo-2,3-dihydrobenzo[b][1,4]dioxine-5-carboxylic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
>95%
1 week  
$299.00   $209.00
- +
5mg
>95%
1 week  
$319.00   $223.00
- +
10mg
>95%
1 week  
$358.00   $250.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA006M31
Chemical Name:
6,7-Dibromo-2,3-dihydrobenzo[b][1,4]dioxine-5-carboxylic acid
CAS Number:
66411-17-4
Molecular Formula:
C9H6Br2O4
Molecular Weight:
337.9495
MDL Number:
MFCD09264171
SMILES:
OC(=O)c1c2OCCOc2cc(c1Br)Br
Properties
Properties
 
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
261  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.5  

Downstream Synthesis Route

[1]OrganicProcessResearchandDevelopment,2017,vol.21,p.18-22

[2]Patent:WO2013/79494,2013,A1.Locationinpatent:Page/Pagecolumn115-116

[3]Patent:US4186135,1980,A

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2013/79494,2013,A1

[2]Lienard,Philippe;Gradoz,Philippe;Greciet,Hélène;Jegham,Samir;Legroux,Didier[OrganicProcessResearchandDevelopment,2017,vol.21,#1,p.18-22]

[3]CurrentPatentAssignee:KYMERATHERAPEUTICSINC-WO2021/188948,2021,A1

Literature
Quotation Request
Company Name:
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Contact Person:
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Email:
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Quantity Required:
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Additional Info:
Submit
SDS
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Tags:66411-17-4 Molecular Formula|66411-17-4 MDL|66411-17-4 SMILES|66411-17-4 6,7-Dibromo-2,3-dihydrobenzo[b][1,4]dioxine-5-carboxylic acid
Catalog No.: AA006M31
66411-17-4,MFCD09264171
66411-17-4 | 6,7-Dibromo-2,3-dihydrobenzo[b][1,4]dioxine-5-carboxylic acid
Pack Size： 1mg
Purity： >95%
1 week
$299.00 $209.00
Pack Size： 5mg
Purity： >95%
1 week
$319.00 $223.00
Pack Size： 10mg
Purity： >95%
1 week
$358.00 $250.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA006M31
Chemical Name: 6,7-Dibromo-2,3-dihydrobenzo[b][1,4]dioxine-5-carboxylic acid
CAS Number: 66411-17-4
Molecular Formula: C9H6Br2O4
Molecular Weight: 337.9495
MDL Number: MFCD09264171
SMILES: OC(=O)c1c2OCCOc2cc(c1Br)Br
Properties
Storage: Keep in dry area;2-8℃;  
Complexity: 261  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 15  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.5  
Downstream Synthesis Route
4442-53-9    66411-17-4 

[1]OrganicProcessResearchandDevelopment,2017,vol.21,p.18-22

[2]Patent:WO2013/79494,2013,A1.Locationinpatent:Page/Pagecolumn115-116

[3]Patent:US4186135,1980,A

66411-17-4    66411-22-1 

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2013/79494,2013,A1

[2]Lienard,Philippe;Gradoz,Philippe;Greciet,Hélène;Jegham,Samir;Legroux,Didier[OrganicProcessResearchandDevelopment,2017,vol.21,#1,p.18-22]

[3]CurrentPatentAssignee:KYMERATHERAPEUTICSINC-WO2021/188948,2021,A1

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