Basic information
- CAS
5098-17-9- Standard SMILES
CCc1nc(C#N)c(N)o1- InChIKey
OPSANIVYYLOPDU-UHFFFAOYSA-N- Molecular formula
- C6H7N3O
- Average molar mass
- 137.14 g/mol
- Monoisotopic mass
- 137.05891186
Names & identifiers
- Preferred name
- 5-Amino-2-ethyl-1,3-oxazole-4-carbonitrile
- IUPAC
- 5-amino-2-ethyl-1,3-oxazole-4-carbonitrile
Names & synonyms
5098-17-95-AMINO-2-ETHYLOXAZOLE-4-CARBONITRILENSC1336855-amino-2-ethyl-1,3-oxazole-4-carbonitrileDTXSID30299920AKOS006339233NSC 133685NSC-133685
Database identifiers
- CAS
5098-17-9- PubChem CID
- 281138
- DTXSID
DTXSID30299920
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 75.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 162
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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