4-((4-Chlorobenzyl)oxy)-N'-(3,4,5-trimethoxybenzylidene)benzohydrazide
Basic information
- CAS
395088-94-5- Standard SMILES
COc1cc(/C=N/NC(=O)c2ccc(OCc3ccc(Cl)cc3)cc2)cc(OC)c1OC- InChIKey
WICVJRLPCIOJLP-VULFUBBASA-N- Molecular formula
- C24H23ClN2O5
- Average molar mass
- 454.9 g/mol
- Monoisotopic mass
- 454.1295495
Names & identifiers
- Preferred name
- 4-((4-Chlorobenzyl)oxy)-N'-(3,4,5-trimethoxybenzylidene)benzohydrazide
- IUPAC
- 4-[(4-chlorophenyl)methoxy]-N-[(E)-(3,4,5-trimethoxyphenyl)methylideneamino]benzamide
- English name
- SALOR-INT L399957-1EA
- Molecular formula
- C24H23ClN2O5
- Molecular weight
- 454.9
Names & synonyms
4-((4-Chlorobenzyl)oxy)-N'-(3,4,5-trimethoxybenzylidene)benzohydrazideRefChem:509405395088-94-5643-223-4AKOS024415864SALOR-INT L399957-1EA4-[(4-chlorophenyl)methoxy]-N-[(E)-(3,4,5-trimethoxyphenyl)methylideneamino]benzamideBenzoic acid, 4-[(4-chlorophenyl)methoxy]-, 2-[(3,4,5-trimethoxyphenyl)methylene]hydrazide
Database identifiers
- CAS
395088-94-5- PubChem CID
- 9622243
- EC Number
- 643-223-4
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 78.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 577
Physicochemical properties
- Density
- 1.22 · 1.22±0.1 g/cm3(Predicted)
- pka
- 11.94 · 11.94±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
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