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1000932-65-9,MFCD09971392
Catalog No.:AA019LCS

1000932-65-9 | 3-[N-(prop-2-yn-1-yl)acetamido]benzoic acid

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Technical Information
Catalog Number:
AA019LCS
Chemical Name:
3-[N-(prop-2-yn-1-yl)acetamido]benzoic acid
CAS Number:
1000932-65-9
Molecular Formula:
C12H11NO3
Molecular Weight:
217.2206
MDL Number:
MFCD09971392
SMILES:
C#CCN(c1cccc(c1)C(=O)O)C(=O)C
Properties
Computed Properties
 
Complexity:
328  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
0.9  

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Tags:1000932-65-9 Molecular Formula|1000932-65-9 MDL|1000932-65-9 SMILES|1000932-65-9 3-[N-(prop-2-yn-1-yl)acetamido]benzoic acid