Basic information
- CAS
256955-45-0- Standard SMILES
O=[N+]([O-])c1cccc(C2Oc3ccccc3C3CC(c4ccccc4)=NN32)c1- InChIKey
XDCKXQFMERWWFC-UHFFFAOYSA-N- Molecular formula
- C22H17N3O3
- Average molar mass
- 371.4 g/mol
- Monoisotopic mass
- 371.12699141
Names & identifiers
- Preferred name
- 5-(3-Nitrophenyl)-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
- IUPAC
- 5-(3-nitrophenyl)-2-phenyl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine
- English name
- 5-(3-nitrophenyl)-2-phenyl-1,10b-dihydro-5H-benzo[e]pyrazolo[1,5-c][1,3]oxazine
- Molecular formula
- C22H17N3O3
- Molecular weight
- 371.39
Names & synonyms
256955-45-05-(3-nitrophenyl)-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine5-(3-nitrophenyl)-2-phenyl-1,10b-dihydrobenzo[e]pyrazolo[1,5-c][1,3]oxazine5-(3-nitrophenyl)-2-phenyl-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazine5-{3-nitrophenyl}-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazineChemDiv1_0002325-(3-nitrophenyl)-2-phenyl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazineHMS587K12CCG-44537STK091383AKOS000486173AKOS016245888
Show more names
5H-Pyrazolo[1,5-c][1,3]benzoxazine, 1,10b-dihydro-5-(3-nitrophenyl)-2-phenyl-5-(3-nitrophenyl)-2-phenyl-1,10b-dihydro-5H-benzo[e]pyrazolo[1,5-c][1,3]oxazine
EU-0067585NS00016391AE-848/32006037SR-01000634366-1Z56758285F1118-02654-(3-NITRO-PH)-2-PHENYL-1,9B-DIHYDRO-5-OXA-3,3A-DIAZA-CYCLOPENTA(A)NAPHTHALENE
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 70.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 613
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)
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%)
Chemistry & industry
Suppliers1 total
济南思考化学有限公司0531-0000 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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