Basic information
- CAS
20711-86-8- Standard SMILES
O=C1C2C3CCC(O3)C2C(=O)N1c1ccc(Cl)cc1- InChIKey
ZKMVVYWUWBYAMV-UHFFFAOYSA-N- Molecular formula
- C14H12ClNO3
- Average molar mass
- 277.7 g/mol
- Monoisotopic mass
- 277.0505709
Names & identifiers
- Preferred name
- 2-(4-Chlorophenyl)hexahydro-1H-4,7-epoxyisoindole-1,3(2H)-dione
- IUPAC
- 2-(4-chlorophenyl)-3a,4,5,6,7,7a-hexahydro-4,7-epoxyisoindole-1,3-dione
Names & synonyms
2-(4-chlorophenyl)hexahydro-1h-4,7-epoxyisoindole-1,3(2h)-dione20711-86-8DTXSID50942921RefChem:1061222DTXCID5013713042-(4-chlorophenyl)-3a,4,5,6,7,7a-hexahydro-4,7-epoxyisoindole-1,3-dioneCBMicro_0477427-Oxabicyclo(2.2.1)heptane-2,3-dicarboximide, N-(p-chlorophenyl)-, exo-(Z)-exo,cis-N-(4-Chlorophenyl)-7-oxabicyclo(2.2.1)heptane-2,3-dicarboximideSCHEMBL3493827BIM-0047915.P001SR-01000195728
Show more names
SR-01000195728-1
Database identifiers
- CAS
20711-86-8- PubChem CID
- 89374
- DTXSID
DTXSID50942921
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 46.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 404
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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