940472-66-2
Catalog No.:AA01FO98

940472-66-2 | (E)-4-[4-(1-Azepanylcarbonyl)anilino]-4-oxo-2-butenoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
500mg
1 week  
$427.00   $299.00
- +
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  • Properties
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Technical Information
Catalog Number:
AA01FO98
Chemical Name:
(E)-4-[4-(1-Azepanylcarbonyl)anilino]-4-oxo-2-butenoic acid
CAS Number:
940472-66-2
Molecular Formula:
C17H20N2O4
Molecular Weight:
316.3517
SMILES:
C1CCCN(CC1)C(=O)C2=CC=C(C=C2)NC(=O)C=CC(=O)O
Properties
Computed Properties
 
Complexity:
459  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
1  
XLogP3:
1.5  

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Tags:940472-66-2 Molecular Formula|940472-66-2 MDL|940472-66-2 SMILES|940472-66-2 (E)-4-[4-(1-Azepanylcarbonyl)anilino]-4-oxo-2-butenoic acid
Catalog No.: AA01FO98
940472-66-2
940472-66-2 | (E)-4-[4-(1-Azepanylcarbonyl)anilino]-4-oxo-2-butenoic acid
Pack Size: 500mg
Purity:
1 week
$427.00 $299.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA01FO98
Chemical Name: (E)-4-[4-(1-Azepanylcarbonyl)anilino]-4-oxo-2-butenoic acid
CAS Number: 940472-66-2
Molecular Formula: C17H20N2O4
Molecular Weight: 316.3517
SMILES: C1CCCN(CC1)C(=O)C2=CC=C(C=C2)NC(=O)C=CC(=O)O
Properties
Complexity: 459  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 23  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 2  
Isotope Atom Count: 0  
Rotatable Bond Count: 4  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 1  
XLogP3: 1.5  
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