Home Aldehydes 5416-80-8
5416-80-8,MFCD00012077
Catalog No.:AA003JF5

5416-80-8 | 2-Methylindole-3-carboxaldehyde

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5g
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$11.00   $8.00
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10g
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  • Technical Information
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  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003JF5
Chemical Name:
2-Methylindole-3-carboxaldehyde
CAS Number:
5416-80-8
Molecular Formula:
C10H9NO
Molecular Weight:
159.1846
MDL Number:
MFCD00012077
SMILES:
O=Cc1c(C)[nH]c2c1cccc2
NSC Number:
11895
Properties
Properties
 
BP:
344.3°C at 760 mmHg  
Form:
Solid  
MP:
200-201 °C(lit.)  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
181  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
1.9  

Literature

Title: (2-Methyl-1-phenyl-sulfonyl-1H-indol-3-yl)methanol.

Journal: Acta crystallographica. Section E, Structure reports online 20080201

Title: Prediction of genotoxicity of chemical compounds by statistical learning methods.

Journal: Chemical research in toxicology 20050601

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SDS
Tags:5416-80-8 Molecular Formula|5416-80-8 MDL|5416-80-8 SMILES|5416-80-8 2-Methylindole-3-carboxaldehyde |Organic_Building_Blocks