7,9-Dichloro-5-(4-CL-phenyl)-2-PH-1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine
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Basic information
- CAS
302913-77-5- Standard SMILES
Clc1ccc(C2Oc3c(Cl)cc(Cl)cc3C3CC(c4ccccc4)=NN32)cc1- InChIKey
IOTFSPZKZUXBDY-UHFFFAOYSA-N- Molecular formula
- C22H15Cl3N2O
- Average molar mass
- 429.7 g/mol
- Monoisotopic mass
- 428.024996
Names & identifiers
- Preferred name
- 7,9-Dichloro-5-(4-CL-phenyl)-2-PH-1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine
- IUPAC
- 7,9-dichloro-5-(4-chlorophenyl)-2-phenyl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine
- English name
- 7,9-dichloro-5-(4-chlorophenyl)-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
- Molecular formula
- C22H15Cl3N2O
- Molecular weight
- 429.73
Names & synonyms
302913-77-5RefChem:5448977,9-Dichloro-5-(4-CL-phenyl)-2-PH-1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazine658-430-57,9-dichloro-5-(4-chlorophenyl)-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine7,9-Dichloro-5-(4-chlorophenyl)-2-phenyl-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazine7,9-dichloro-5-(4-chlorophenyl)-2-phenyl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazineSTK740071AKOS002184686AKOS016245349ST50079190AP-845/41779857
Show more names
5H-Pyrazolo[1,5-c][1,3]benzoxazine, 7,9-dichloro-5-(4-chlorophenyl)-1,10b-dihydro-2-phenyl-
2,4-dichloro-6-(4-chlorophenyl)-9-phenyl-6H,10aH-benzo[e]2-pyrazolino[1,5-c]1, 3-oxazine
Database identifiers
- CAS
302913-77-5- PubChem CID
- 3678697
- EC Number
- 658-430-5
Properties
Computed structural propertiesFilling in
- XLogP
- 6.7
- Topological polar surface area
- 24.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 588
Physicochemical properties
- Boiling point
- 553.3 · 553.3±60.0 °C(Predicted)
- Density
- 1.46 · 1.46±0.1 g/cm3(Predicted)
- pka
- 2.89 · 2.89±0.40(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 413 · H413-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, P273, 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
- H413-H315-H319-H335
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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