3-(4-(Benzyloxy)phenyl)-N'-(4-ethylbenzylidene)-1H-pyrazole-5-carbohydrazide
Basic information
- CAS
302918-64-5- Standard SMILES
CCc1ccc(/C=N/NC(=O)c2cc(-c3ccc(OCc4ccccc4)cc3)n[nH]2)cc1- InChIKey
MYXRJXMYSDVPGA-WPWMEQJKSA-N- Molecular formula
- C26H24N4O2
- Average molar mass
- 424.5 g/mol
- Monoisotopic mass
- 424.18992602
Names & identifiers
- Preferred name
- 3-(4-(Benzyloxy)phenyl)-N'-(4-ethylbenzylidene)-1H-pyrazole-5-carbohydrazide
- IUPAC
- N-[(E)-(4-ethylphenyl)methylideneamino]-3-(4-phenylmethoxyphenyl)-1H-pyrazole-5-carboxamide
- English name
- N-[(E)-(4-ethylphenyl)methylideneamino]-3-(4-phenylmethoxyphenyl)-1H-pyrazole-5-carboxamide
- Molecular formula
- C26H24N4O2
- Molecular weight
- 424.5
Names & synonyms
3-(4-(Benzyloxy)phenyl)-N'-(4-ethylbenzylidene)-1H-pyrazole-5-carbohydrazide302918-64-5RefChem:492471651-961-3STL362714AKOS001618589ST022425(E)-3-(4-(benzyloxy)phenyl)-N'-(4-ethylbenzylidene)-1H-pyrazole-5-carbohydrazide3-[4-(benzyloxy)phenyl]-N'-[(E)-(4-ethylphenyl)methylidene]-1H-pyrazole-5-carbohydrazideN-[(1E)-2-(4-ethylphenyl)-1-azavinyl]{3-[4-(phenylmethoxy)phenyl]pyrazol-5-yl} carboxamideN-[(E)-(4-ethylphenyl)methylideneamino]-3-(4-phenylmethoxyphenyl)-1H-pyrazole-5-carboxamide1H-Pyrazole-3-carboxylic acid, 5-[4-(phenylmethoxy)phenyl]-, 2-[(4-ethylphenyl)methylene]hydrazide
Database identifiers
- CAS
302918-64-5- PubChem CID
- 6869481
- EC Number
- 651-961-3
Properties
Computed structural properties
- XLogP
- 5.4
- Topological polar surface area
- 79.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 591
Physicochemical properties
- Density
- 1.18 · 1.18±0.1 g/cm3(Predicted)
- pka
- 9.92 · 9.92±0.46(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
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
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 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 Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
Suppliers
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Related reactions
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Compound notes
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