Basic information
- CAS
64082-38-8- Standard SMILES
O=C(Nc1n[nH]c(-c2ccc([N+](=O)[O-])o2)n1)C(Cl)Cl- InChIKey
DCUSTCXDLWEAEP-UHFFFAOYSA-N- Molecular formula
- C8H5Cl2N5O4
- Average molar mass
- 306.06 g/mol
- Monoisotopic mass
- 304.971859
Names & identifiers
- Preferred name
- Acetamide, 2,2-dichloro-N-(3-(5-nitro-2-furyl)-5-triazol-5-yl)-
- IUPAC
- 2,2-dichloro-N-[5-(5-nitrofuran-2-yl)-1H-1,2,4-triazol-3-yl]acetamide
Names & synonyms
64082-38-8s-Triazole, 5-(2,2-dichloroacetamido)-3-(5-nitro-2-furyl)-Acetamide, 2,2-dichloro-N-(3-(5-nitro-2-furyl)-5-triazol-5-yl)-2,2-Dichloro-N-(3-(5-nitro-2-furyl)-5-triazol-5-yl)acetamideDTXSID70214273RefChem:314291DTXCID701367642,2-dichloro-N-[5-(5-nitrofuran-2-yl)-1H-1,2,4-triazol-3-yl]acetamide
Database identifiers
- CAS
64082-38-8- PubChem CID
- 5486322
- DTXSID
DTXSID70214273- Nikkaji
- J78.710H
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 130 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 366
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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