7391-31-3,MFCD12115815
Catalog No.:AA01BTHU

7391-31-3 | 2-benzoylbutanenitrile

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
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA01BTHU
Chemical Name:
2-benzoylbutanenitrile
CAS Number:
7391-31-3
Molecular Formula:
C11H11NO
Molecular Weight:
173.2111
MDL Number:
MFCD12115815
SMILES:
CCC(C(=O)c1ccccc1)C#N
Properties
Computed Properties
 
Complexity:
220  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.4  

Downstream Synthesis Route

[1]Rimoldi,Isabella;Facchetti,Giorgio;Nava,Donatella;Contente,MartinaLetizia;Gandolfi,Raffella[TetrahedronAsymmetry,2016,vol.27,#9-10,p.389-396]

Literature
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Additional Info:
SDS
Tags:7391-31-3 Molecular Formula|7391-31-3 MDL|7391-31-3 SMILES|7391-31-3 2-benzoylbutanenitrile
Catalog No.: AA01BTHU
7391-31-3,MFCD12115815
7391-31-3 | 2-benzoylbutanenitrile
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
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA01BTHU
Chemical Name: 2-benzoylbutanenitrile
CAS Number: 7391-31-3
Molecular Formula: C11H11NO
Molecular Weight: 173.2111
MDL Number: MFCD12115815
SMILES: CCC(C(=O)c1ccccc1)C#N
Properties
Complexity: 220  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 13  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 1  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.4  
Downstream Synthesis Route
50-99-7    614-16-4    7391-31-3 

[1]Rimoldi,Isabella;Facchetti,Giorgio;Nava,Donatella;Contente,MartinaLetizia;Gandolfi,Raffella[TetrahedronAsymmetry,2016,vol.27,#9-10,p.389-396]

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