Basic information
- CAS
91038-02-7- Standard SMILES
CCOC(=O)c1ccc(NN=NC(C)(C)C)cc1- InChIKey
DTPGCCFRUMGUPF-UHFFFAOYSA-N- Molecular formula
- C13H19N3O2
- Average molar mass
- 249.31 g/mol
- Monoisotopic mass
- 249.14772686
Names & identifiers
- Preferred name
- Ethyl 4-(2-tert-butyliminohydrazinyl)benzoate
- IUPAC
- ethyl 4-(2-tert-butyliminohydrazinyl)benzoate
Names & synonyms
91038-02-7ethyl 4-(2-tert-butyliminohydrazinyl)benzoateNSC313427DTXSID10317257NSC-313427Ethyl 4-[(2E)-3-tert-butyltriaz-2-en-1-yl]benzoate
Database identifiers
- CAS
91038-02-7- PubChem CID
- 329636
- DTXSID
DTXSID10317257
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 63.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 289
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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