Basic information
- CAS
357623-63-3- Standard SMILES
O=C1C2C3C=CC(C4CC34)C2C(=O)N1c1ccccc1Cl- InChIKey
PEZUNMPHVSMCGS-UHFFFAOYSA-N- Molecular formula
- C17H14ClNO2
- Average molar mass
- 299.7 g/mol
- Monoisotopic mass
- 299.0713064
Names & identifiers
- Preferred name
- 2-(2-chlorophenyl)hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione
- IUPAC
- 4-(2-chlorophenyl)-4-azatetracyclo[5.3.2.02,6.08,10]dodec-11-ene-3,5-dione
Names & synonyms
2-(2-chlorophenyl)-4,4a,5,5a,6,6a-hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dioneCBMicro_007015RCL L204927SMSF0006813STK269982AKOS000477867AKOS022075544CB09370BIM-0006764.P001ST50853704SR-01000440835SR-01000440835-1
Show more names
2-(2-chlorophenyl)hexahydro-4,6-ethenocyclopropa[f]isoindole-1,3(2H,3aH)-dione4-(2-chlorophenyl)-4-azatetracyclo[5.3.2.0<2,6>.0<8,10>]dodec-11-ene-3,5-dione357623-63-3
Database identifiers
- CAS
357623-63-3- PubChem CID
- 2860127
- EC Number
- 126-265-3
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 37.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 523
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
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P280, P305+P351+P338, and P337+P317 (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 CategoriesEye Irrit. 2 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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