Basic information
- CAS
303060-91-5- Standard SMILES
COc1ccc(C2=NN3C(C2)c2cc(Br)ccc2OC3c2ccccc2)cc1- InChIKey
ZFVAGRNVSJGZSJ-UHFFFAOYSA-N- Molecular formula
- C23H19BrN2O2
- Average molar mass
- 435.3 g/mol
- Monoisotopic mass
- 434.06299
Names & identifiers
- Preferred name
- 4-(9-BR-5-PH-1,10B-Dihydropyrazolo(1,5-C)(1,3)benzoxazin-2-YL)PH methyl ether
- IUPAC
- 9-bromo-2-(4-methoxyphenyl)-5-phenyl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine
Names & synonyms
303060-91-5RefChem:5149064-(9-BR-5-PH-1,10B-Dihydropyrazolo(1,5-C)(1,3)benzoxazin-2-YL)PH methyl ether662-162-44-(9-bromo-5-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-2-yl)phenyl methyl ether9-Bromo-2-(4-methoxyphenyl)-5-phenyl-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazineAKOS000618890AKOS027276283ST50338205AG-690/124093911-(2-bromo-6-phenyl(6H,10aH-benzo[e]2-pyrazolino[1,5-c]1,3-oxazaperhydroin-9-y l))-4-methoxybenzene
Database identifiers
- CAS
303060-91-5- PubChem CID
- 3121908
- EC Number
- 662-162-4
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 571
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)
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%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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