959054-36-5,MFCD12804847
Catalog No.:AA019SA9

959054-36-5 | methyl 2-(3-amino-1H-1,2,4-triazol-1-yl)acetate

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Technical Information
Catalog Number:
AA019SA9
Chemical Name:
methyl 2-(3-amino-1H-1,2,4-triazol-1-yl)acetate
CAS Number:
959054-36-5
Molecular Formula:
C5H8N4O2
Molecular Weight:
156.1426
MDL Number:
MFCD12804847
SMILES:
COC(=O)Cn1cnc(n1)N
Properties
Computed Properties
 
Complexity:
151  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
-0.9  

Literature
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SDS
Tags:959054-36-5 Molecular Formula|959054-36-5 MDL|959054-36-5 SMILES|959054-36-5 methyl 2-(3-amino-1H-1,2,4-triazol-1-yl)acetate
Catalog No.: AA019SA9
959054-36-5,MFCD12804847
959054-36-5 | methyl 2-(3-amino-1H-1,2,4-triazol-1-yl)acetate
This product is typically in stock,please click "Inquire" below or contact us at [email protected]for pricing and availability information.
Inquire
Technical Information
Catalog Number: AA019SA9
Chemical Name: methyl 2-(3-amino-1H-1,2,4-triazol-1-yl)acetate
CAS Number: 959054-36-5
Molecular Formula: C5H8N4O2
Molecular Weight: 156.1426
MDL Number: MFCD12804847
SMILES: COC(=O)Cn1cnc(n1)N
Properties
Complexity: 151  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 11  
Hydrogen Bond Acceptor Count: 5  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: -0.9  
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