Basic information
- CAS
303061-32-7- Standard SMILES
COc1ccc(C2=NN3C(C(=O)c4ccc(C)cc4)Oc4c(Cl)cc(Cl)cc4C3C2)cc1- InChIKey
ISMNVDQZCRUTBB-UHFFFAOYSA-N- Molecular formula
- C25H20Cl2N2O3
- Average molar mass
- 467.3 g/mol
- Monoisotopic mass
- 466.0850979
Names & identifiers
- Preferred name
- [7,9-Dichloro-2-(4-methoxyphenyl)-1,10B-dihydropyrazolo[1,5-C][1,3]benzoxazin-5-YL](4-methylphenyl)methanone
- IUPAC
- [7,9-dichloro-2-(4-methoxyphenyl)-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl]-(4-methylphenyl)methanone
Names & synonyms
[7,9-dichloro-2-(4-methoxyphenyl)-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl](4-methylphenyl)methanone(7,9-DICHLORO-2-(4-METHOXYPHENYL)-1,10B-DIHYDROPYRAZOLO(1,5-C)(1,3)BENZOXAZIN-5-YL)(4-METHYLPHENYL)METHANONERefChem:405280303061-32-7663-270-4AKOS024424041
Database identifiers
- CAS
303061-32-7- PubChem CID
- 4583944
- EC Number
- 663-270-4
Properties
Computed structural properties
- XLogP
- 6.3
- Topological polar surface area
- 51.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 718
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 39 reports by companies from 2 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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