3-(4-(Benzyloxy)phenyl)-N'-(1-naphthylmethylene)-1H-pyrazole-5-carbohydrazide
Basic information
- CAS
302918-58-7- Standard SMILES
O=C(N/N=C/c1cccc2ccccc12)c1cc(-c2ccc(OCc3ccccc3)cc2)n[nH]1- InChIKey
DEOLLYZAGNPFSI-RDRPBHBLSA-N- Molecular formula
- C28H22N4O2
- Average molar mass
- 446.5 g/mol
- Monoisotopic mass
- 446.17427596
Names & identifiers
- Preferred name
- 3-(4-(Benzyloxy)phenyl)-N'-(1-naphthylmethylene)-1H-pyrazole-5-carbohydrazide
- IUPAC
- N-[(E)-naphthalen-1-ylmethylideneamino]-3-(4-phenylmethoxyphenyl)-1H-pyrazole-5-carboxamide
- English name
- 5-[4-(benzyloxy)phenyl]-N'-[(1E)-(naphthalen-1-yl)methylidene]-1H-pyrazole-3-carbohydrazide
- Molecular formula
- C28H22N4O2
- Molecular weight
- 446.5
Names & synonyms
302918-58-73-(4-(BENZYLOXY)PHENYL)-N'-(1-NAPHTHYLMETHYLENE)-1H-PYRAZOLE-5-CARBOHYDRAZIDERefChem:492468651-969-73-(4-(Benzyloxy)phenyl)-N'-(naphthalen-1-ylmethylene)-1H-pyrazole-5-carbohydrazideAKOS001018248ST022250Z56792622N-((1E)-2-naphthyl-1-azavinyl){3-[4-(phenylmethoxy)phenyl]pyrazol-5-yl}carboxa mide5-[4-(benzyloxy)phenyl]-N'-[(1E)-(naphthalen-1-yl)methylidene]-1H-pyrazole-3-carbohydrazide1H-Pyrazole-3-carboxylic acid, 5-[4-(phenylmethoxy)phenyl]-, 2-(1-naphthalenylmethylene)hydrazide
Database identifiers
- CAS
302918-58-7- PubChem CID
- 6869482
- EC Number
- 651-969-7
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 79.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 671
Physicochemical properties
- Density
- 1.23 · 1.230±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- 9.706 · 9.706±0.46(predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
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-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
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Related reactions
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Compound notes
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