N-(furan-2-ylmethyl)-2-(3-nitro-1,2,4-triazol-1-yl)acetamide
Basic information
- CAS
313387-25-6- Standard SMILES
O=C(Cn1cnc([N+](=O)[O-])n1)NCc1ccco1- InChIKey
ZWUUDAVSPPWADR-UHFFFAOYSA-N- Molecular formula
- C9H9N5O4
- Average molar mass
- 251.2 g/mol
- Monoisotopic mass
- 251.06545379
Names & identifiers
- Preferred name
- N-(furan-2-ylmethyl)-2-(3-nitro-1,2,4-triazol-1-yl)acetamide
- IUPAC
- N-(furan-2-ylmethyl)-2-(3-nitro-1,2,4-triazol-1-yl)acetamide
Names & synonyms
313387-25-6N-(2-Furanylmethyl)-3-nitro-1H-1,2,4-triazole-1-acetamideN-(furan-2-ylmethyl)-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamideN-(furan-2-ylmethyl)-2-(3-nitro-1,2,4-triazol-1-yl)acetamideOprea1_007057Oprea1_366601DTXSID301197055STK342482AKOS003278174ST50685944Z605730004N-(2-furylmethyl)-2-(3-nitro(1,2,4-triazolyl))acetamide
Show more names
N-(2-furylmethyl)-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamideN-[(furan-2-yl)methyl]-2-(3-nitro-1H-1,2,4-triazol-1-yl)acetamide
Database identifiers
- CAS
313387-25-6- PubChem CID
- 742287
- DTXSID
DTXSID301197055
Properties
Computed structural properties
- XLogP
- -0.3
- Topological polar surface area
- 119 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 321
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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