Basic information
- CAS
69833-26-7- Standard SMILES
CCCC(=O)Nc1cccc(C)c1- InChIKey
HHJVHZGGWADBKL-UHFFFAOYSA-N- Molecular formula
- C11H15NO
- Average molar mass
- 177.24 g/mol
- Monoisotopic mass
- 177.1153641
Names & identifiers
- Preferred name
- N-(3-methylphenyl)butanamide
- IUPAC
- N-(3-methylphenyl)butanamide
Names & synonyms
N-(3-methylphenyl)butanamide69833-26-7Butanamide,N-(3-methylphenyl)-Butanamide, N-(3-methylphenyl)-m-Butyrotoluididem-ButyrotoluidineNSC404445SCHEMBL13994594DTXSID20323622HHJVHZGGWADBKL-UHFFFAOYSA-NAKOS002944027NSC-404445
Show more names
AO-548/11198962
Database identifiers
- CAS
69833-26-7- PubChem CID
- 346262
- DTXSID
DTXSID20323622- Nikkaji
- J2.725.393H
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 167
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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