Home Iodos 313678-93-2
313678-93-2,MFCD09037469
Catalog No.:AA003HB3
313678-93-2 | 3-Iodo-5-methylpyridin-2(1H)-one
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250mg
1 week  
$109.00
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1g
1 week  
$178.00
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5g
1 week  
$509.00
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10g
1 week  
$953.00
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  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003HB3
Chemical Name:
3-Iodo-5-methylpyridin-2(1H)-one
CAS Number:
313678-93-2
Molecular Formula:
C6H6INO
Molecular Weight:
235.0224
MDL Number:
MFCD09037469
IUPAC Name:
3-iodo-5-methyl-1H-pyridin-2-one
InChI:
InChI=1S/C6H6INO/c1-4-2-5(7)6(9)8-3-4/h2-3H,1H3,(H,8,9)
InChI Key:
ASWXKNUHPBTHJI-UHFFFAOYSA-N
SMILES:
Cc1cc(I)c(=O)[nH]c1
Properties
Computed Properties
 
Complexity:
205  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.949g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
235.024g/mol
Monoisotopic Mass:
234.949g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  

Synonyms
 
313678-93-2 
3-Iodo-5-methylpyridin-2-ol 
CTK4G6974 
DTXSID00654784 
ZX-RL003447 
9941AD 
ZINC12359476 
2(1H)-Pyridinone,3-iodo-5-methyl- 
AKOS015853938 
AKOS022178201 
BS-2053 
FCH1324082 
3-Iodo-5-methylpyridin-2(1H)-one 
RTR-013345 
AC-27534 
OR310163 
3-Iodo-5-methylpyridin-2-ol, AldrichCPR 
AJ-125993 
FT-0681658 
KS-00002326 
A-6427 
I14-30022 
C6H6INO 
2-HYDROXY-3-IODO-5-METHYLPYRIDINE 
3-Iodo-5-methyl-2(1H)pyridone 
MFCD09037469 
ACMC-20antm 
AC1Q2OHN 
SCHEMBL7919457 
SCHEMBL13964265 
Literature
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