4(9-CL-2(2-Naphthyl)1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazin-5-YL)PH ME ether
Basic information
- CAS
303060-26-6- Standard SMILES
COc1ccc(C2Oc3ccc(Cl)cc3C3CC(c4ccc5ccccc5c4)=NN32)cc1- InChIKey
SSHVRSKIJMVKPD-UHFFFAOYSA-N- Molecular formula
- C27H21ClN2O2
- Average molar mass
- 440.9 g/mol
- Monoisotopic mass
- 440.1291556
Names & identifiers
- Preferred name
- 4(9-CL-2(2-Naphthyl)1,10B-dihydropyrazolo(1,5-C)(1,3)benzoxazin-5-YL)PH ME ether
- IUPAC
- 9-chloro-5-(4-methoxyphenyl)-2-naphthalen-2-yl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazine
Names & synonyms
303060-26-64(9-CL-2(2-NAPHTHYL)1,10B-DIHYDROPYRAZOLO(1,5-C)(1,3)BENZOXAZIN-5-YL)PH ME ETHERRefChem:506300662-905-29-Chloro-5-(4-methoxyphenyl)-2-(naphthalen-2-yl)-5,10b-dihydro-1H-benzo[e]pyrazolo[1,5-c][1,3]oxazineAKOS02442399512-chloro-7-(4-methoxyphenyl)-4-(naphthalen-2-yl)-8-oxa-5,6-diazatricyclo[7.4.0.0(2),]trideca-1(13),4,9,11-tetraene12-chloro-7-(4-methoxyphenyl)-4-(naphthalen-2-yl)-8-oxa-5,6-diazatricyclo[7.4.0.0,trideca-1(13),4,9,11-tetraene
Database identifiers
- CAS
303060-26-6- PubChem CID
- 3317864
- EC Number
- 662-905-2
Properties
Computed structural properties
- XLogP
- 6.7
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 693
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%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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