methyl 2-[(N-tert-butyl-C-ethenylcarbonimidoyl)amino]benzoate
Basic information
- CAS
73750-47-7- Standard SMILES
C=CC(=NC(C)(C)C)Nc1ccccc1C(=O)OC- InChIKey
DDIFUEHLQYSWOO-UHFFFAOYSA-N- Molecular formula
- C15H20N2O2
- Average molar mass
- 260.33 g/mol
- Monoisotopic mass
- 260.15247789
Names & identifiers
- Preferred name
- methyl 2-[(N-tert-butyl-C-ethenylcarbonimidoyl)amino]benzoate
- IUPAC
- methyl 2-[(N-tert-butyl-C-ethenylcarbonimidoyl)amino]benzoate
- English name
- methyl 2-[(C-ethenyl-N-tert-butyl-carbonimidoyl)amino]benzoate
- Molecular formula
- C15H20N2O2
- Molecular weight
- 260.3315
Names & synonyms
73750-47-7NSC319890DTXSID70317713AG-G-92066NSC-319890Methyl 2-[(1E)-N-tert-butylprop-2-enimidamido]benzoatemethyl 2-[(C-ethenyl-N-tert-butyl-carbonimidoyl)amino]benzoate
Database identifiers
- CAS
73750-47-7- PubChem CID
- 330679
- DTXSID
DTXSID70317713
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 50.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 356
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Related reactions
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Compound notes
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