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64074-25-5,MFCD13191564
Catalog No.:AA00EYAS

64074-25-5 | 1H-1,2,4-Triazole-3-carboxylicacid,1-(cyanomethyl)-,methylester(9CI)

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
95%
2 weeks  
$1,811.00   $1,268.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00EYAS
Chemical Name:
1H-1,2,4-Triazole-3-carboxylicacid,1-(cyanomethyl)-,methylester(9CI)
CAS Number:
64074-25-5
Molecular Formula:
C6H6N4O2
Molecular Weight:
166.1374
MDL Number:
MFCD13191564
SMILES:
COC(=O)c1nn(cn1)CC#N
NSC Number:
344520
Properties
Computed Properties
 
Complexity:
221  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
0.1  

Literature
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SDS
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Tags:64074-25-5 Molecular Formula|64074-25-5 MDL|64074-25-5 SMILES|64074-25-5 1H-1,2,4-Triazole-3-carboxylicacid,1-(cyanomethyl)-,methylester(9CI)
Catalog No.: AA00EYAS
64074-25-5,MFCD13191564
64074-25-5 | 1H-1,2,4-Triazole-3-carboxylicacid,1-(cyanomethyl)-,methylester(9CI)
Pack Size： 5g
Purity： 95%
2 weeks
$1,811.00 $1,268.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00EYAS
Chemical Name: 1H-1,2,4-Triazole-3-carboxylicacid,1-(cyanomethyl)-,methylester(9CI)
CAS Number: 64074-25-5
Molecular Formula: C6H6N4O2
Molecular Weight: 166.1374
MDL Number: MFCD13191564
SMILES: COC(=O)c1nn(cn1)CC#N
NSC Number: 344520
Properties
Complexity: 221  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 12  
Hydrogen Bond Acceptor Count: 5  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 0.1  
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