4-Bromo-2-(2-(4-ethoxybenzoyl)carbohydrazonoyl)phenyl benzoate
Basic information
- CAS
767335-96-6- Standard SMILES
CCOc1ccc(C(=O)N/N=C/c2cc(Br)ccc2OC(=O)c2ccccc2)cc1- InChIKey
OHLVAVJATKZISG-MFKUBSTISA-N- Molecular formula
- C23H19BrN2O4
- Average molar mass
- 467.3 g/mol
- Monoisotopic mass
- 466.05282
Names & identifiers
- Preferred name
- 4-Bromo-2-(2-(4-ethoxybenzoyl)carbohydrazonoyl)phenyl benzoate
- IUPAC
- [4-bromo-2-[(E)-[(4-ethoxybenzoyl)hydrazinylidene]methyl]phenyl] benzoate
- English name
- SALOR-INT L385654-1EA
- Molecular formula
- C23H19BrN2O4
- Molecular weight
- 467.31
Names & synonyms
767335-96-64-BROMO-2-(2-(4-ETHOXYBENZOYL)CARBOHYDRAZONOYL)PHENYL BENZOATERefChem:519427650-354-0AKOS024414659SALOR-INT L385654-1EA
Database identifiers
- CAS
767335-96-6- PubChem CID
- 9623218
- EC Number
- 650-354-0
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 77 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 586
Physicochemical properties
- Symbol(GHS)
- 7 · GHS07,GHS09
- Signal word
- Warning
- Hazard statements
- 317 · H317-H410
- Precautionary statements
- 261 · P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-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
H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]
P261, P272, P273, P280, P302+P352, P321, P333+P317, P362+P364, 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 CategoriesSkin Sens. 1 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07,GHS09
- Hazard statements
- H317-H410
- Precautionary statements
- P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P273-P391-P501
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Related reactions
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Compound notes
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