Ethyl 4-(3-methylphenoxy)-3-propanamidobenzoate
Basic information
- CAS
81401-52-7- Standard SMILES
CCOC(=O)c1ccc(Oc2cccc(C)c2)c(NC(=O)CC)c1- InChIKey
RQVORHAVDIYSKA-UHFFFAOYSA-N- Molecular formula
- C19H21NO4
- Average molar mass
- 327.4 g/mol
- Monoisotopic mass
- 327.14705815
Names & identifiers
- Preferred name
- Ethyl 4-(3-methylphenoxy)-3-propanamidobenzoate
- IUPAC
- ethyl 4-(3-methylphenoxy)-3-(propanoylamino)benzoate
Names & synonyms
81401-52-7Ethyl 4-(3-methylphenoxy)-3-propanamidobenzoateDTXSID60511001
Database identifiers
- CAS
81401-52-7- PubChem CID
- 12832017
- DTXSID
DTXSID60511001
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 64.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 426
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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