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478249-31-9,MFCD02571494
Catalog No.:AA00IRED

478249-31-9 | Methyl 4-(2-methylbenzoyl)-1h-pyrrole-2-carboxylate

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  • Technical Information
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Technical Information
Catalog Number:
AA00IRED
Chemical Name:
Methyl 4-(2-methylbenzoyl)-1h-pyrrole-2-carboxylate
CAS Number:
478249-31-9
Molecular Formula:
C14H13NO3
Molecular Weight:
243.2579
MDL Number:
MFCD02571494
SMILES:
COC(=O)c1[nH]cc(c1)C(=O)c1ccccc1C
Properties
Computed Properties
 
Complexity:
329  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
4  
XLogP3:
2.6  

Literature
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SDS
Tags:478249-31-9 Molecular Formula|478249-31-9 MDL|478249-31-9 SMILES|478249-31-9 Methyl 4-(2-methylbenzoyl)-1h-pyrrole-2-carboxylate