N-(3-bromo-2-methylphenyl)-2,2,3,3-tetramethylcyclopropanecarboxamide
Basic information
- CAS
883789-55-7- Standard SMILES
Cc1c(Br)cccc1NC(=O)C1C(C)(C)C1(C)C- InChIKey
IYVFXALQMGMSJQ-UHFFFAOYSA-N- Molecular formula
- C15H20BrNO
- Average molar mass
- 310.23 g/mol
- Monoisotopic mass
- 309.07283
Names & identifiers
- Preferred name
- N-(3-bromo-2-methylphenyl)-2,2,3,3-tetramethylcyclopropanecarboxamide
- IUPAC
- N-(3-bromo-2-methylphenyl)-2,2,3,3-tetramethylcyclopropane-1-carboxamide
- English name
- N-(3-Bromo-2-methylphenyl)-2,2,3,3-tetramethylcyclopropanecarboxamide
- Molecular formula
- C15H20BrNO
- Molecular weight
- 310.23
Names & synonyms
AKOS024325454N-(3-bromo-2-methylphenyl)-2,2,3,3-tetramethylcyclopropanecarboxamideCyclopropanecarboxamide, N-(3-bromo-2-methylphenyl)-2,2,3,3-tetramethyl-
Database identifiers
- CAS
883789-55-7- PubChem CID
- 4464337
- EC Number
- 146-207-0
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 29.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 336
Physicochemical properties
- Boiling point
- 384.519 · 384.519±30.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.287 · 1.287±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 14.211 · 14.211±0.70(predicted)
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Compound notes
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