N-(2H,3H-benzo[3,4-e]1,4-dioxin-6-yl)-2-[4-(4-methylphenyl)phenoxy]acetamide
Basic information
- CAS
303032-12-4- Standard SMILES
Cc1ccc(-c2ccc(OCC(=O)Nc3ccc4c(c3)OCCO4)cc2)cc1- InChIKey
CYGZUHWMZPMNHL-UHFFFAOYSA-N- Molecular formula
- C23H21NO4
- Average molar mass
- 375.4 g/mol
- Monoisotopic mass
- 375.14705815
Names & identifiers
- Preferred name
- N-(2H,3H-benzo[3,4-e]1,4-dioxin-6-yl)-2-[4-(4-methylphenyl)phenoxy]acetamide
- IUPAC
- N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[4-(4-methylphenyl)phenoxy]acetamide
- English name
- N-(2,3-Dihydro-1,4-benzodioxin-6-yl)-2-((4'-me(1,1'-biphenyl)-4-yl)oxy)acetamide
- Molecular formula
- C23H21NO4
- Molecular weight
- 375.42
Names & synonyms
CBMicro_046818Oprea1_161238AKOS002264629BIM-0046870.P001ST50189212AE-641/14043023F3095-3651N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(4'-methyl-4-biphenylyl)oxy]acetamideN-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(4'-methyl[1,1'-biphenyl]-4-yl)oxy]acetamideN-(2H,3H-benzo[3,4-e]1,4-dioxin-6-yl)-2-[4-(4-methylphenyl)phenoxy]acetamideN-(2,3-DIHYDRO-1,4-BENZODIOXIN-6-YL)-2-((4'-ME(1,1'-BIPHENYL)-4-YL)OXY)ACETAMIDEN-(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)-2-((4'-methyl-[1,1'-biphenyl]-4-yl)oxy)acetamide
Show more names
Acetamide, N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[(4′-methyl[1,1′-biphenyl]-4-yl)oxy]-
Database identifiers
- CAS
303032-12-4- PubChem CID
- 978475
- EC Number
- 144-137-5
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 56.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 497
Physicochemical properties
- Boiling point
- 606.431 · 606.431±55.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.246 · 1.246±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 12.301 · 12.301±0.20(predicted)
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