Basic information
- CAS
324030-76-4- Standard SMILES
CCOC(=O)COc1ccccc1C=NNC(=O)COc1ccc(Br)cc1OC- InChIKey
NWDGUEUPJFGXND-UHFFFAOYSA-N- Molecular formula
- C20H21BrN2O6
- Average molar mass
- 465.3 g/mol
- Monoisotopic mass
- 464.0583
Names & identifiers
- Preferred name
- Ethyl 2-[2-[[[2-(4-bromo-2-methoxyphenoxy)acetyl]hydrazinylidene]methyl]phenoxy]acetate
- IUPAC
- ethyl 2-[2-[[[2-(4-bromo-2-methoxyphenoxy)acetyl]hydrazinylidene]methyl]phenoxy]acetate
- English name
- ethyl (2-{2-[(4-bromo-2-methoxyphenoxy)acetyl]carbohydrazonoyl}phenoxy)acetate
- Molecular formula
- C20H21BrN2O6
- Molecular weight
- 465.29
Names & synonyms
CBMicro_022399ethyl [2-({2-[(4-bromo-2-methoxyphenoxy)acetyl]hydrazinylidene}methyl)phenoxy]acetateethyl (2-{2-[(4-bromo-2-methoxyphenoxy)acetyl]carbohydrazonoyl}phenoxy)acetate
Database identifiers
- CAS
324030-76-4- PubChem CID
- 1048853
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 95.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 11
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 547
Physicochemical properties
- Density
- 1.376 · 1.376±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 11.661 · 11.661±0.46(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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