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Home Other Building Blocks 876903-48-9
876903-48-9,MFCD30534302
Catalog No.:AA004K53

876903-48-9 | Benzoic acid, 5-[2-formyl-5-(hydroxymethyl)-1H-pyrrol-1-yl]-2-hydroxy-

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Technical Information
Catalog Number:
AA004K53
Chemical Name:
Benzoic acid, 5-[2-formyl-5-(hydroxymethyl)-1H-pyrrol-1-yl]-2-hydroxy-
CAS Number:
876903-48-9
Molecular Formula:
C13H11NO5
Molecular Weight:
261.2301
MDL Number:
MFCD30534302
SMILES:
OCc1ccc(n1c1ccc(c(c1)C(=O)O)O)C=O
Properties
Properties
 
MP:
>270°C (dec.)  
Storage:
-20 ℃;Keep in dry area;  

Computed Properties
 
Complexity:
348  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Rotatable Bond Count:
4  
XLogP3:
1  

Literature
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Additional Info:
SDS
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Tags:876903-48-9 Molecular Formula|876903-48-9 MDL|876903-48-9 SMILES|876903-48-9 Benzoic acid, 5-[2-formyl-5-(hydroxymethyl)-1H-pyrrol-1-yl]-2-hydroxy-