2-(4-chlorophenyl)-1H-[1,4]benzodioxino[3,2-f]indole
Basic information
- CAS
58679-35-9- Standard SMILES
Clc1ccc(-c2cc3cc4c(cc3[nH]2)Oc2ccccc2O4)cc1- InChIKey
RUPHFDFBJZKGGB-UHFFFAOYSA-N- Molecular formula
- C20H12ClNO2
- Average molar mass
- 333.8 g/mol
- Monoisotopic mass
- 333.0556563
Names & identifiers
- Preferred name
- 2-(4-chlorophenyl)-1H-[1,4]benzodioxino[3,2-f]indole
- IUPAC
- 2-(4-chlorophenyl)-1H-[1,4]benzodioxino[3,2-f]indole
Names & synonyms
58679-35-92-(4-chlorophenyl)-1H-[1,4]benzodioxino[3,2-f]indoleNSC296337DTXSID00315707NSC-2963372-(4-Chlorophenyl)-1H-[1,4]benzodioxino[2,3-f]indole
Database identifiers
- CAS
58679-35-9- PubChem CID
- 326155
- DTXSID
DTXSID00315707
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 34.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 453
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Compound notes
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