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214758-41-5,MFCD01313711
Catalog No.:AA00BCNG

214758-41-5 | 2-(1,3-BENZODIOXOL-5-YLOXY)NICOTINIC ACID

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Technical Information
Catalog Number:
AA00BCNG
Chemical Name:
2-(1,3-BENZODIOXOL-5-YLOXY)NICOTINIC ACID
CAS Number:
214758-41-5
Molecular Formula:
C13H9NO5
Molecular Weight:
259.2143
MDL Number:
MFCD01313711
SMILES:
OC(=O)c1cccnc1Oc1ccc2c(c1)OCO2
Properties
Computed Properties
 
Complexity:
337  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
2.1  

Literature
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SDS
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Tags:214758-41-5 Molecular Formula|214758-41-5 MDL|214758-41-5 SMILES|214758-41-5 2-(1,3-BENZODIOXOL-5-YLOXY)NICOTINIC ACID