2-(3,5-Dimethyl-4-(phenylazo)phenyl)isoindoline
Basic information
- CAS
198283-49-7- Standard SMILES
Cc1cc(N2Cc3ccccc3C2)cc(C)c1N=Nc1ccccc1- InChIKey
NIFGZXYFFRYUSE-UHFFFAOYSA-N- Molecular formula
- C22H21N3
- Average molar mass
- 327.4 g/mol
- Monoisotopic mass
- 327.17354768
Names & identifiers
- Preferred name
- 2-(3,5-Dimethyl-4-(phenylazo)phenyl)isoindoline
- IUPAC
- [4-(1,3-dihydroisoindol-2-yl)-2,6-dimethylphenyl]-phenyldiazene
Names & synonyms
2-(3,5-DIMETHYL-4-(PHENYLAZO)PHENYL)ISOINDOLINEDTXSID201039553AKOS024340820198283-49-71H-Isoindole, 2-[3,5-dimethyl-4-(2-phenyldiazenyl)phenyl]-2,3-dihydro-
Database identifiers
- CAS
198283-49-7- PubChem CID
- 3484775
- DTXSID
DTXSID201039553
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 28 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 430
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…