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3807-61-2,MFCD03664121
Catalog No.:AA00CJ7T

3807-61-2 | 1-Benzyl-2,5-dimethyl-1h-pyrrole-3-carboxylic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$170.00   $119.00
- +
250mg
95%
in stock  
$329.00   $230.00
- +
1g
95%
in stock  
$774.00 $542.00
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00CJ7T
Chemical Name:
1-Benzyl-2,5-dimethyl-1h-pyrrole-3-carboxylic acid
CAS Number:
3807-61-2
Molecular Formula:
C14H15NO2
Molecular Weight:
229.2744
MDL Number:
MFCD03664121
SMILES:
OC(=O)c1cc(n(c1C)Cc1ccccc1)C
Properties
Computed Properties
 
Complexity:
273  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.6  

Literature
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SDS
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Tags:3807-61-2 Molecular Formula|3807-61-2 MDL|3807-61-2 SMILES|3807-61-2 1-Benzyl-2,5-dimethyl-1h-pyrrole-3-carboxylic acid
Catalog No.: AA00CJ7T
3807-61-2,MFCD03664121
3807-61-2 | 1-Benzyl-2,5-dimethyl-1h-pyrrole-3-carboxylic acid
Pack Size： 100mg
Purity： 95%
in stock
$170.00 $119.00
Pack Size： 250mg
Purity： 95%
in stock
$329.00 $230.00
Pack Size： 1g
Purity： 95%
in stock
$774.00 $542.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00CJ7T
Chemical Name: 1-Benzyl-2,5-dimethyl-1h-pyrrole-3-carboxylic acid
CAS Number: 3807-61-2
Molecular Formula: C14H15NO2
Molecular Weight: 229.2744
MDL Number: MFCD03664121
SMILES: OC(=O)c1cc(n(c1C)Cc1ccccc1)C
Properties
Complexity: 273  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 17  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.6  
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