Basic information
- CAS
40782-26-1- Standard SMILES
CC(C)(C)c1cccc(C(N)=O)c1- InChIKey
VYZIRLYFWZFTRE-UHFFFAOYSA-N- Molecular formula
- C11H15NO
- Average molar mass
- 177.24 g/mol
- Monoisotopic mass
- 177.1153641
Names & identifiers
- Preferred name
- 3-Tert-butylbenzamide
- IUPAC
- 3-tert-butylbenzamide
Names & synonyms
3-tert-butylbenzamide40782-26-13-(tert-Butyl)benzamideBenzamide,3-(1,1-dimethylethyl)-NSC86593NCIOpen2_001107SCHEMBL179447SCHEMBL7771557SCHEMBL14053842SCHEMBL16952040DTXSID10961198NSC-86593
Show more names
AKOS0062896493-tert-Butylbenzene-1-carboximidic acidTS-02464
Database identifiers
- CAS
40782-26-1- PubChem CID
- 257963
- DTXSID
DTXSID10961198- Nikkaji
- J2.699.538H
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 43.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 193
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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