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858515-71-6,MFCD12617315
Catalog No.:AA01CBWB

858515-71-6 | BB-22 3-Carboxyindole Metabolite

This product is typically in stock,please click "Inquire" below or
contact us at [email protected] for pricing and availability information.
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA01CBWB
Chemical Name:
BB-22 3-Carboxyindole Metabolite
CAS Number:
858515-71-6
Molecular Formula:
C16H19NO2
Molecular Weight:
257.3276
MDL Number:
MFCD12617315
SMILES:
OC(=O)c1cn(c2c1cccc2)CC1CCCCC1
Properties
Computed Properties
 
Complexity:
325  
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:
3  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
3.8  

Literature
Quotation Request
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SDS
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Tags:858515-71-6 Molecular Formula|858515-71-6 MDL|858515-71-6 SMILES|858515-71-6 BB-22 3-Carboxyindole Metabolite
Catalog No.: AA01CBWB
858515-71-6,MFCD12617315
858515-71-6 | BB-22 3-Carboxyindole Metabolite
This product is typically in stock,please click "Inquire" below or contact us at [email protected]for pricing and availability information.
Inquire
Technical Information
Catalog Number: AA01CBWB
Chemical Name: BB-22 3-Carboxyindole Metabolite
CAS Number: 858515-71-6
Molecular Formula: C16H19NO2
Molecular Weight: 257.3276
MDL Number: MFCD12617315
SMILES: OC(=O)c1cn(c2c1cccc2)CC1CCCCC1
Properties
Complexity: 325  
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: 3  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 3.8  
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