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930-33-6,MFCD01311031
Catalog No.:AA00GR76

930-33-6 | 1,2,4-Triazolin-3-one

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
97%
in stock  
$8.00   $6.00
- +
10g
97%
in stock  
$12.00   $8.00
- +
25g
97%
in stock  
$19.00   $14.00
- +
100g
97%
in stock  
$70.00   $49.00
- +
500g
97%
in stock  
$273.00   $192.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00GR76
Chemical Name:
1,2,4-Triazolin-3-one
CAS Number:
930-33-6
Molecular Formula:
C2H3N3O
Molecular Weight:
85.0647
MDL Number:
MFCD01311031
SMILES:
O=c1nc[nH][nH]1
Properties
Properties
 
BP:
412.6°C at 760 mmHg  
Form:
Solid  
MP:
234 - 237°C  
Storage:
Inert atmosphere;Room Temperature;  

Computed Properties
 
Complexity:
97  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
6  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
XLogP3:
-0.8  

Upstream Synthesis Route

[1]Patent:US2003/187274,2003,A1,

[1]Patent:US2016/46588,2016,A1,.Locationinpatent:Paragraph0108;0109;0110;0111

[2]Patent:KR2016/28405,2016,A,.Locationinpatent:Paragraph0092-0098

[1]JournalofLabelledCompoundsandRadiopharmaceuticals,1996,vol.38,#1,p.87-94

[2]BulletinofthePolishAcademyofSciences,Chemistry,1986,vol.34,#7-8,p.295-303

[3]JournalofHeterocyclicChemistry,2006,vol.43,#2,p.503-508

[4]JournalofMolecularStructure,1996,vol.384,#2-3,p.87-99

[1]HeteroatomChemistry,2003,vol.14,#1,p.50-55

[1]JournalofOrganicChemistry,1982,vol.47,#3,p.474-482

[2]JournalofNaturalProducts,2000,vol.63,#6,p.777-781

Downstream Synthesis Route

[1]JournaloftheAmericanChemicalSociety,1957,vol.79,p.2839,2843

[1]AnnalidiChimica,1959,vol.49,p.1649,1656,1663

[2]ChemistryofHeterocyclicCompounds,2011,vol.46,p.1534-1535

[1]ChemischeBerichte,1898,vol.31,p.381

[1]JournalofOrganicChemistry,1982,vol.47,p.474-482

[2]JournalofOrganicChemistry,1982,vol.47,p.474-482

[3]JournalofOrganicChemistry,1982,vol.47,p.474-482

[1]BulletinofthePolishAcademyofSciences:Chemistry,1986,vol.34,p.295-303

Literature
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SDS
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Tags:930-33-6 Molecular Formula|930-33-6 MDL|930-33-6 SMILES|930-33-6 1,2,4-Triazolin-3-one