Home Amines 115065-79-7
115065-79-7,MFCD09750993
Catalog No.:AA000FSD

115065-79-7 | (E,Z)-2-(2-Benzyloxycarbonylamino-4-thiazol)-4-(3-methyl-2-butenyloxycarbonyl)-2-butenoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
97%
in stock  
$9.00   $7.00
- +
250mg
97%
in stock  
$12.00   $8.00
- +
1g
97%
in stock  
$19.00   $14.00
- +
5g
95%
in stock  
$87.00   $61.00
- +
10g
95%
in stock  
$153.00   $107.00
- +
25g
95%
in stock  
$303.00   $212.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA000FSD
Chemical Name:
(E,Z)-2-(2-Benzyloxycarbonylamino-4-thiazol)-4-(3-methyl-2-butenyloxycarbonyl)-2-butenoic acid
CAS Number:
115065-79-7
Molecular Formula:
C21H21N2O6S-
Molecular Weight:
429.4662
MDL Number:
MFCD09750993
SMILES:
[O-]C(=O)C(=CCC(=O)OCC=C(C)C)c1csc(n1)NC(=O)OCc1ccccc1
Properties
Computed Properties
 
Complexity:
668  
Covalently-Bonded Unit Count:
1  
Defined Bond Stereocenter Count:
1  
Heavy Atom Count:
30  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
11  
XLogP3:
3.6  

Downstream Synthesis Route
C21H22N2O6S 
  36923-21-4   
ceftibuten 

[1]Patent:CN109293678,2019,A.Locationinpatent:Paragraph0062-0068

[1]CurrentPatentAssignee:YANTAIKUNYILIQUIDCRYSTALDISPLAYMAT-CN111116508,2020,ALocationinpatent:Paragraph0023-0042

Literature
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Additional Info:
SDS
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Tags:115065-79-7 Molecular Formula|115065-79-7 MDL|115065-79-7 SMILES|115065-79-7 (E,Z)-2-(2-Benzyloxycarbonylamino-4-thiazol)-4-(3-methyl-2-butenyloxycarbonyl)-2-butenoic acid