4-(2-(2-((4-Chlorobenzyl)oxy)benzoyl)carbohydrazonoyl)phenyl 4-ethoxybenzoate
Basic information
- CAS
769148-26-7- Standard SMILES
CCOc1ccc(C(=O)Oc2ccc(/C=N/NC(=O)c3ccccc3OCc3ccc(Cl)cc3)cc2)cc1- InChIKey
GPZHGGCHJOZRJW-BIZUNTBRSA-N- Molecular formula
- C30H25ClN2O5
- Average molar mass
- 529 g/mol
- Monoisotopic mass
- 528.1451996
Names & identifiers
- Preferred name
- 4-(2-(2-((4-Chlorobenzyl)oxy)benzoyl)carbohydrazonoyl)phenyl 4-ethoxybenzoate
- IUPAC
- [4-[(E)-[[2-[(4-chlorophenyl)methoxy]benzoyl]hydrazinylidene]methyl]phenyl] 4-ethoxybenzoate
- English name
- SALOR-INT L397733-1EA
- Molecular formula
- C30H25ClN2O5
- Molecular weight
- 528.98
Names & synonyms
4-(2-(2-((4-CHLOROBENZYL)OXY)BENZOYL)CARBOHYDRAZONOYL)PHENYL 4-ETHOXYBENZOATERefChem:511494769148-26-7637-981-5AKOS024415677SALOR-INT L397733-1EA
Database identifiers
- CAS
769148-26-7- PubChem CID
- 9633686
- EC Number
- 637-981-5
Properties
Computed structural properties
- XLogP
- 6.7
- Topological polar surface area
- 86.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 11
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 756
Physicochemical properties
- Density
- 1.223 · 1.223±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 12.042 · 12.042±0.46(predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 413 · H413-H317
- Precautionary statements
- 261 · P261-P272-P280-P302+P352-P333+P313-P321-P363-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
H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]
P261, P272, P273, P280, P302+P352, P321, P333+P317, P362+P364, 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 CategoriesSkin Sens. 1 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H413-H317
- Precautionary statements
- P261-P272-P280-P302+P352-P333+P313-P321-P363-P501
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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