N-(3,5-dinitrothiophen-2-yl)acetamide
Basic information
- CAS
51249-08-2- Standard SMILES
CC(=O)Nc1sc([N+](=O)[O-])cc1[N+](=O)[O-]- InChIKey
YIKSUWUCPDHMSU-UHFFFAOYSA-N- Molecular formula
- C6H5N3O5S
- Average molar mass
- 231.19 g/mol
- Monoisotopic mass
- 230.99499144
Names & identifiers
- Preferred name
- N-(3,5-dinitrothiophen-2-yl)acetamide
- IUPAC
- N-(3,5-dinitrothiophen-2-yl)acetamide
Names & synonyms
51249-08-2N-(3,5-dinitrothiophen-2-yl)acetamideNSC512288SCHEMBL10744298DTXSID80310735NSC231478NSC-231478NSC-512288
Database identifiers
- CAS
51249-08-2- PubChem CID
- 314210
- DTXSID
DTXSID80310735- Nikkaji
- J1.452.229H
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 149 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 298
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…