Basic information
- CAS
5540-94-3- Standard SMILES
COc1ccc(NC(=O)COc2ccc(Cl)cc2C)cc1- InChIKey
IGJNCQZXFKCBIM-UHFFFAOYSA-N- Molecular formula
- C16H16ClNO3
- Average molar mass
- 305.75 g/mol
- Monoisotopic mass
- 305.0818711
Names & identifiers
- Preferred name
- 2-(4-chloro-2-methylphenoxy)-N-(4-methoxyphenyl)acetamide
- IUPAC
- 2-(4-chloro-2-methylphenoxy)-N-(4-methoxyphenyl)acetamide
Names & synonyms
2-(4-chloro-2-methylphenoxy)-N-(4-methoxyphenyl)acetamideCBMicro_023188Cambridge id 5540943Oprea1_339283DTXSID60970750CCG-10637STK413036AKOS001043421ST009902BIM-0023302.P001AK-968/11369151Z18757476
Database identifiers
- CAS
5540-94-3- PubChem CID
- 690902
- DTXSID
DTXSID60970750
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 47.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 331
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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