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Home Other Building Blocks 1010-54-4
1010-54-4,MFCD03787260
Catalog No.:AA0003DN

1010-54-4 | 3H-1,2,4-Triazol-3-one, 2,4-dihydro-5-methyl-4-phenyl-

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
1 week  
$56.00   $39.00
- +
250mg
95%
1 week  
$94.00   $66.00
- +
1g
95%
1 week  
$259.00   $181.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA0003DN
Chemical Name:
3H-1,2,4-Triazol-3-one, 2,4-dihydro-5-methyl-4-phenyl-
CAS Number:
1010-54-4
Molecular Formula:
C9H9N3O
Molecular Weight:
175.1873
MDL Number:
MFCD03787260
SMILES:
Cc1n[nH]c(=O)n1c1ccccc1
Properties
Computed Properties
 
Complexity:
243  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
0.9  

Downstream Synthesis Route

[1]Hrebabecky,Hubert;Beranek,Jiri[CollectionofCzechoslovakChemicalCommunications,1985,vol.50,#2,p.779-788]

[1]Gehlen;Benatzky[JustusLiebigsAnnalenderChemie,1958,vol.615,p.60,63]

[1]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-WO2007/18941,2007,A2Locationinpatent:Page/Pagecolumn46

Literature
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Additional Info:
SDS
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Tags:1010-54-4 Molecular Formula|1010-54-4 MDL|1010-54-4 SMILES|1010-54-4 3H-1,2,4-Triazol-3-one, 2,4-dihydro-5-methyl-4-phenyl-