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Home Aldehydes 22383-86-4
22383-86-4,MFCD00075802
Catalog No.:AA006Y2V

22383-86-4 | Benzaldehyde,2-hydroxy-3,4-dimethoxy-6-methyl-

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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA006Y2V
Chemical Name:
Benzaldehyde,2-hydroxy-3,4-dimethoxy-6-methyl-
CAS Number:
22383-86-4
Molecular Formula:
C10H12O4
Molecular Weight:
196.1999
MDL Number:
MFCD00075802
SMILES:
COc1c(OC)cc(c(c1O)C=O)C
Properties
Computed Properties
 
Complexity:
195  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
1.9  

Literature

Title: Tautomerism in large databases.

Journal: Journal of computer-aided molecular design 20100601

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SDS
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Tags:22383-86-4 Molecular Formula|22383-86-4 MDL|22383-86-4 SMILES|22383-86-4 Benzaldehyde,2-hydroxy-3,4-dimethoxy-6-methyl-