2-Methoxy-4-(2-(2-methylbenzoyl)carbohydrazonoyl)phenyl 3,4-dichlorobenzoate
Basic information
- CAS
765275-03-4- Standard SMILES
COc1cc(/C=N/NC(=O)c2ccccc2C)ccc1OC(=O)c1ccc(Cl)c(Cl)c1- InChIKey
BDOKRCNQBSAQBW-LGJNPRDNSA-N- Molecular formula
- C23H18Cl2N2O4
- Average molar mass
- 457.3 g/mol
- Monoisotopic mass
- 456.0643624
Names & identifiers
- Preferred name
- 2-Methoxy-4-(2-(2-methylbenzoyl)carbohydrazonoyl)phenyl 3,4-dichlorobenzoate
- IUPAC
- [2-methoxy-4-[(E)-[(2-methylbenzoyl)hydrazinylidene]methyl]phenyl] 3,4-dichlorobenzoate
- English name
- SALOR-INT L455849-1EA
- Molecular formula
- C23H18Cl2N2O4
- Molecular weight
- 457.31
Names & synonyms
2-METHOXY-4-(2-(2-METHYLBENZOYL)CARBOHYDRAZONOYL)PHENYL 3,4-DICHLOROBENZOATERefChem:474291765275-03-4656-563-3AKOS024416909SALOR-INT L455849-1EA
Database identifiers
- CAS
765275-03-4- PubChem CID
- 9632076
- EC Number
- 656-563-3
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 77 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 647
Physicochemical properties
- Density
- 1.303 · 1.303±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 11.82 · 11.820±0.46(predicted)
- Symbol(GHS)
- 9 · GHS09
- Signal word
- Warning
- Hazard statements
- 410 · H410
- Precautionary statements
- 273 · P273-P391-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]
P273, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAquatic Acute 1 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS09
- Hazard statements
- H410
- Precautionary statements
- P273-P391-P501
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…