2-nitro-N-[(E)-(2-phenylmethoxyphenyl)methylideneamino]aniline
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Basic information
- CAS
303760-91-0- Standard SMILES
O=[N+]([O-])c1ccccc1N/N=C/c1ccccc1OCc1ccccc1- InChIKey
UWNDUGAVAGVIKN-UHFFFAOYSA-N- Molecular formula
- C20H17N3O3
- Average molar mass
- 347.4 g/mol
- Monoisotopic mass
- 347.12699141
Names & identifiers
- Preferred name
- 2-nitro-N-[(E)-(2-phenylmethoxyphenyl)methylideneamino]aniline
- IUPAC
- 2-nitro-N-[(E)-(2-phenylmethoxyphenyl)methylideneamino]aniline
- English name
- 1-[2-(benzyloxy)benzylidene]-2-(2-nitrophenyl)hydrazine
- Molecular formula
- C20H17N3O3
- Molecular weight
- 347.37
Names & synonyms
ZINC325778132-nitro-N-[(E)-(2-phenylmethoxyphenyl)methylideneamino]aniline2-(benzyloxy)benzaldehyde {2-nitrophenyl}hydrazoneCCG-6073MFCD00812952STK095351AKOS000483880303760-91-0BIM-0017443.P001ZINC000004119238(O)(N+)(=O)c1ccccc1NN=Cc1ccccc1OCc1ccccc1AN-329/10734062
Show more names
1-[2-(benzyloxy)benzylidene]-2-(2-nitrophenyl)hydrazineBenzaldehyde, 2-(phenylmethoxy)-, 2-(2-nitrophenyl)hydrazone(1E)-1-[2-(benzyloxy)benzylidene]-2-(2-nitrophenyl)hydrazine
2(BENZYLOXY)BENZALDEHYDE(2NITROPHENYL)HYDRAZONE(1E)1(2(BENZYLOXY)BENZYLIDENE)2(2NITROPHENYL)HYDRAZINE2NITRON((E)(2PHENYLMETHOXYPHENYL)METHYLIDENEAMINO)ANILINEC1=CC=C(C=C1)COC2=CC=CC=C2C=NNC3=CC=CC=C3(N+)(=O)(O)N-(2-BENZYLOXY-BENZYLIDENE)-N'-(2-NITRO-PHENYL)-HYDRAZINE
Database identifiers
- CAS
303760-91-0- PubChem CID
- 5338628
- EC Number
- 168-099-4
Properties
Computed structural propertiesFilling in
- XLogP
- 5.4
- Topological polar surface area
- 79.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 460
Physicochemical properties
- Boiling point
- 533.2 · 533.2±50.0 °C(Predicted)
- Density
- 1.19 · 1.19±0.1 g/cm3(Predicted)
- pka
- 12.46 · 12.46±0.10(Predicted)
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, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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