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Home Carboxes 13991-44-1
13991-44-1,MFCD20926192
Catalog No.:AA001BQ2

13991-44-1 | Trans-4-oxo-1,2-cyclohexanedicarboxylic acid dimethyl ester

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$73.00   $51.00
- +
250mg
95%
in stock  
$97.00   $68.00
- +
500mg
95%
in stock  
$161.00   $113.00
- +
1g
95%
in stock  
$241.00   $169.00
- +
5g
95%
in stock  
$726.00   $508.00
- +
10g
95%
in stock  
$1,209.00   $846.00
- +
25g
95%
in stock  
$2,658.00   $1,861.00
- +
50g
95%
in stock  
$3,624.00   $2,537.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA001BQ2
Chemical Name:
Trans-4-oxo-1,2-cyclohexanedicarboxylic acid dimethyl ester
CAS Number:
13991-44-1
Molecular Formula:
C10H14O5
Molecular Weight:
214.2152
MDL Number:
MFCD20926192
SMILES:
COC(=O)[C@@H]1CC(=O)CC[C@H]1C(=O)OC
Properties
Computed Properties
 
Complexity:
284  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Rotatable Bond Count:
4  
XLogP3:
-0.2  

Downstream Synthesis Route

[1]Shea,KennethJ.;GauthierJr.,DonaldR.[TetrahedronLetters,1994,vol.35,#40,p.7311-7314]

[1]Shea,KennethJ.;GauthierJr.,DonaldR.[TetrahedronLetters,1994,vol.35,#40,p.7311-7314]

CASUnavailable 
  13991-44-1 

[1]Shea,KennethJ.;GauthierJr.,DonaldR.[TetrahedronLetters,1994,vol.35,#40,p.7311-7314]

[1]CurrentPatentAssignee:MERCK&COINC-US2015/99719,2015,A1

[2]CurrentPatentAssignee:MERCK&COINC-WO2015/51479,2015,A1

[3]CurrentPatentAssignee:MERCK&COINC-WO2015/54038,2015,A1

[4]CurrentPatentAssignee:MERCK&COINC-WO2015/123089,2015,A1

[1]CurrentPatentAssignee:MERCK&COINC-US2015/99719,2015,A1Locationinpatent:Paragraph0208

[2]CurrentPatentAssignee:MERCK&COINC-WO2015/51479,2015,A1Locationinpatent:Page/Pagecolumn50;51

[3]CurrentPatentAssignee:MERCK&COINC-WO2015/123089,2015,A1Locationinpatent:Page/Pagecolumn44-45

[4]CurrentPatentAssignee:MERCK&COINC-WO2015/54038,2015,A1Locationinpatent:Page/Pagecolumn45;46

Literature
Quotation Request
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Additional Info:
SDS
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Tags:13991-44-1 Molecular Formula|13991-44-1 MDL|13991-44-1 SMILES|13991-44-1 Trans-4-oxo-1,2-cyclohexanedicarboxylic acid dimethyl ester