2-(3-Nitro-1H-1,2,4-triazol-1-yl)acetohydrazide - CAS 149453-08-7
Catalog: |
BB045937 |
Product Name: |
2-(3-Nitro-1H-1,2,4-triazol-1-yl)acetohydrazide |
CAS: |
149453-08-7 |
Synonyms: |
2-(3-nitro-1,2,4-triazolyl)acetohydrazide |
IUPAC Name: | 2-(3-nitro-1,2,4-triazol-1-yl)acetohydrazide |
Description: | 2-(3-Nitro-1H-1,2,4-triazol-1-yl)acetohydrazide (CAS# 149453-08-7 ) is a useful research chemical. |
Molecular Weight: | 186.13 |
Molecular Formula: | C4H6N6O3 |
Canonical SMILES: | C1=NC(=NN1CC(=O)NN)[N+](=O)[O-] |
InChI: | InChI=1S/C4H6N6O3/c5-7-3(11)1-9-2-6-4(8-9)10(12)13/h2H,1,5H2,(H,7,11) |
InChI Key: | JBMRIQFRAFGFKN-UHFFFAOYSA-N |
Density: | 2.00±0.1 g/cm3 (Predicted) |
Complexity: | 214 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 186.05013807 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 186.05013807 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 132 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -1.7 |
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