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400878-21-9,MFCD03001265
Catalog No.:AA00CASI

400878-21-9 | 3-Methoxy-3-oxoprop-1-en-1-yl 4-(trifluoromethyl)benzoate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$265.00   $185.00
- +
1g
95%
in stock  
$372.00   $260.00
- +
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Technical Information
Catalog Number:
AA00CASI
Chemical Name:
3-Methoxy-3-oxoprop-1-en-1-yl 4-(trifluoromethyl)benzoate
CAS Number:
400878-21-9
Molecular Formula:
C12H9F3O4
Molecular Weight:
274.1927
MDL Number:
MFCD03001265
SMILES:
COC(=O)/C=C/OC(=O)c1ccc(cc1)C(F)(F)F
Properties
Computed Properties
 
Complexity:
355  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
7  
Rotatable Bond Count:
5  
Undefined Bond Stereocenter Count:
1  
XLogP3:
2.7  

Literature
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SDS
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Tags:400878-21-9 Molecular Formula|400878-21-9 MDL|400878-21-9 SMILES|400878-21-9 3-Methoxy-3-oxoprop-1-en-1-yl 4-(trifluoromethyl)benzoate