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3815-30-3,MFCD00017251
Catalog No.:AA003UUP

3815-30-3 | (E)-4-(4-Methoxyphenyl)but-3-en-2-one

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1mg
>95%
1 week  
$299.00   $209.00
- +
5mg
>95%
1 week  
$319.00   $223.00
- +
500mg
>95%
1 week  
$339.00   $238.00
- +
1g
>95%
1 week  
$414.00   $290.00
- +
5g
>95%
1 week  
$813.00   $569.00
- +
  • Technical Information
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003UUP
Chemical Name:
(E)-4-(4-Methoxyphenyl)but-3-en-2-one
CAS Number:
3815-30-3
Molecular Formula:
C11H12O2
Molecular Weight:
176.2118
MDL Number:
MFCD00017251
SMILES:
CC(=O)C=CC1=CC=C(C=C1)OC
Properties
Computed Properties
 
Complexity:
188  
Covalently-Bonded Unit Count:
1  
Defined Bond Stereocenter Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
3  
XLogP3:
2.1  

Literature

Title: Quantum chemical- and 3-D-QSAR (CoMFA) studies of benzalacetones and 1,1,1-trifluoro-4-phenyl-3-buten-2-ones.

Journal: Bioorganic & medicinal chemistry letters 20020902

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SDS
Tags:3815-30-3 Molecular Formula|3815-30-3 MDL|3815-30-3 SMILES|3815-30-3 (E)-4-(4-Methoxyphenyl)but-3-en-2-one