Basic information
- CAS
429631-60-7- Standard SMILES
Cc1cc(OCC(=O)NC2CCCCCC2)ccc1Cl- InChIKey
ZXUXBANGOSYERO-UHFFFAOYSA-N- Molecular formula
- C16H22ClNO2
- Average molar mass
- 295.8 g/mol
- Monoisotopic mass
- 295.1339066
Names & identifiers
- Preferred name
- 2-(4-chloro-3-methylphenoxy)-N-cycloheptylacetamide
- IUPAC
- 2-(4-chloro-3-methylphenoxy)-N-cycloheptylacetamide
- English name
- 2-(4-chloro-3-methylphenoxy)-N-cycloheptylacetamide
- Molecular formula
- C16H22ClNO2
- Molecular weight
- 295.8
Names & synonyms
2-(4-chloro-3-methylphenoxy)-N-cycloheptylacetamideSTK225297AKOS002546927429631-60-7ST50933569AK-968/40733954Acetamide, 2-(4-chloro-3-methylphenoxy)-N-cycloheptyl-
Database identifiers
- CAS
429631-60-7- PubChem CID
- 841571
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 303
Physicochemical properties
- Boiling point
- 489.2 · 489.2±33.0 °C(Predicted)
- Density
- 1.14 · 1.14±0.1 g/cm3(Predicted)
- pka
- 14.26 · 14.26±0.20(Predicted)
Chemistry & industry
Suppliers1 total
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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