Acetanilide, 2-tert-butyl-
Basic information
- CAS
72807-56-8- Standard SMILES
CC(C)(C)CC(=O)Nc1ccccc1- InChIKey
HZCWUGRBJGUUFB-UHFFFAOYSA-N- Molecular formula
- C12H17NO
- Average molar mass
- 191.27 g/mol
- Monoisotopic mass
- 191.13101417
Names & identifiers
- Preferred name
- Acetanilide, 2-tert-butyl-
- IUPAC
- 3,3-dimethyl-N-phenylbutanamide
Names & synonyms
Acetanilide, 2-tert-butyl-72807-56-8DTXSID50278671RefChem:315767DTXCID702298273,3-dimethyl-N-phenylbutanamideNSC9044t-butyl-acetanilideSCHEMBL4110940SCHEMBL10962729SCHEMBL110880613,3-Dimethyl-n-phenyl-butanamide
Show more names
NSC-9044AKOS006241252DS-004625ST51014250
Database identifiers
- CAS
72807-56-8- PubChem CID
- 222576
- DTXSID
DTXSID50278671- Nikkaji
- J2.803.202A
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 187
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…