Basic information
- CAS
54240-88-9- Standard SMILES
N#CCN(CC#N)C(=O)c1cccs1- InChIKey
UKNXXMRBUFQJHI-UHFFFAOYSA-N- Molecular formula
- C9H7N3OS
- Average molar mass
- 205.24 g/mol
- Monoisotopic mass
- 205.03098303
Names & identifiers
- Preferred name
- N,N-bis(cyanomethyl)thiophene-2-carboxamide
- IUPAC
- N,N-bis(cyanomethyl)thiophene-2-carboxamide
Names & synonyms
N,N-bis(cyanomethyl)thiophene-2-carboxamideN,N-bis(cyanomethyl)-2-thienylcarboxamideMaybridge3_001055HMS1433P21CCG-47229STK065827AKOS000670857IDI1_012442ST010688N,N-bis(cyanomethyl)-2-thiophenecarboxamideSR-01000411250SR-01000411250-1
Show more names
SR-01000411250-2
Database identifiers
- CAS
54240-88-9- PubChem CID
- 710672
- EC Number
- 141-017-4
Properties
Computed structural properties
- XLogP
- 0.3
- Topological polar surface area
- 96.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 293
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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