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5666-05-7,MFCD18430032
Catalog No.:AA01DTCI

5666-05-7 | Benzenebutanoic acid, a-(phenylmethyl)-

Pack Size
Purity
Availability
Price(USD)
Quantity
  
50mg
95%
3 weeks  
$193.00   $135.00
- +
100mg
95%
3 weeks  
$259.00   $182.00
- +
250mg
95%
3 weeks  
$347.00   $243.00
- +
500mg
95%
3 weeks  
$611.00   $428.00
- +
1g
95%
3 weeks  
$797.00   $558.00
- +
2.5g
95%
3 weeks  
$1,504.00   $1,053.00
- +
5g
95%
3 weeks  
$2,199.00   $1,539.00
- +
10g
95%
3 weeks  
$3,233.00   $2,263.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA01DTCI
Chemical Name:
Benzenebutanoic acid, a-(phenylmethyl)-
CAS Number:
5666-05-7
Molecular Formula:
C17H18O2
Molecular Weight:
254.3236
MDL Number:
MFCD18430032
SMILES:
OC(=O)C(Cc1ccccc1)CCc1ccccc1
Properties
Computed Properties
 
Complexity:
262  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
6  
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0  
XLogP3:
4  

Downstream Synthesis Route

[1]Patent:US2016/271081,2016,A1

[1]AdvancedSynthesisandCatalysis,2018,vol.360,p.925-931

Literature

Title: Design, synthesis and in vitro evaluation of a series of α-substituted phenylpropanoic acid PPARγ agonists to further investigate the stereochemistry-activity relationship.

Journal: Bioorganic & medicinal chemistry 20121101

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SDS
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Tags:5666-05-7 Molecular Formula|5666-05-7 MDL|5666-05-7 SMILES|5666-05-7 Benzenebutanoic acid, a-(phenylmethyl)-
Catalog No.: AA01DTCI
5666-05-7,MFCD18430032
5666-05-7 | Benzenebutanoic acid, a-(phenylmethyl)-
Pack Size： 50mg
Purity： 95%
3 weeks
$193.00 $135.00
Pack Size： 100mg
Purity： 95%
3 weeks
$259.00 $182.00
Pack Size： 250mg
Purity： 95%
3 weeks
$347.00 $243.00
Pack Size： 500mg
Purity： 95%
3 weeks
$611.00 $428.00
Pack Size： 1g
Purity： 95%
3 weeks
$797.00 $558.00
Pack Size： 2.5g
Purity： 95%
3 weeks
$1,504.00 $1,053.00
Pack Size： 5g
Purity： 95%
3 weeks
$2,199.00 $1,539.00
Pack Size： 10g
Purity： 95%
3 weeks
$3,233.00 $2,263.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA01DTCI
Chemical Name: Benzenebutanoic acid, a-(phenylmethyl)-
CAS Number: 5666-05-7
Molecular Formula: C17H18O2
Molecular Weight: 254.3236
MDL Number: MFCD18430032
SMILES: OC(=O)C(Cc1ccccc1)CCc1ccccc1
Properties
Complexity: 262  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 19  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 6  
Undefined Atom Stereocenter Count: 1  
Undefined Bond Stereocenter Count: 0  
XLogP3: 4  
Downstream Synthesis Route
6628-68-8    5666-05-7 

[1]Patent:US2016/271081,2016,A1

5669-19-2    401636-52-0    5666-05-7 

[1]AdvancedSynthesisandCatalysis,2018,vol.360,p.925-931

Literature fold

Title: Design, synthesis and in vitro evaluation of a series of α-substituted phenylpropanoic acid PPARγ agonists to further investigate the stereochemistry-activity relationship.

Journal: Bioorganic & medicinal chemistry20121101

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