1-[5-(3-Azidobutyl)thiophen-2-yl]ethan-1-one
Basic information
- CAS
88962-21-4- Standard SMILES
CC(=O)c1ccc(CCC(C)N=[N+]=[N-])s1- InChIKey
UXPKRQNKZFJZPR-UHFFFAOYSA-N- Molecular formula
- C10H13N3OS
- Average molar mass
- 223.3 g/mol
- Monoisotopic mass
- 223.07793322
Names & identifiers
- Preferred name
- 1-[5-(3-Azidobutyl)thiophen-2-yl]ethan-1-one
- IUPAC
- 1-[5-(3-azidobutyl)thiophen-2-yl]ethanone
Names & synonyms
88962-21-41-[5-(3-Azidobutyl)thiophen-2-yl]ethan-1-oneDTXSID70710947
Database identifiers
- CAS
88962-21-4- PubChem CID
- 54377542
- DTXSID
DTXSID70710947
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 59.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 276
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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