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Basic information
- CAS
6951-67-3- Standard SMILES
Cc1c(C2OC(=O)c3ccccc32)n(C)c2ccccc12- InChIKey
NTQQWNSXWGMDPW-UHFFFAOYSA-N- Molecular formula
- C18H15NO2
- Average molar mass
- 277.3 g/mol
- Monoisotopic mass
- 277.11027872
Names & identifiers
- Preferred name
- 3-(1,3-Dimethyl-1h-indol-2-yl)-2-benzofuran-1(3h)-one
- IUPAC
- 3-(1,3-dimethylindol-2-yl)-3H-2-benzofuran-1-one
Names & synonyms
6951-67-33-(1,3-Dimethyl-1H-indol-2-yl)isobenzofuran-1(3H)-one3-(1,3-dimethyl-1h-indol-2-yl)-2-benzofuran-1(3h)-one3-(1,3-dimethyl-1H-indol-2-yl)-1,3-dihydro-2-benzofuran-1-one3-(1,3-dimethylindol-2-yl)-3H-isobenzofuran-1-oneNSC523673-(1,3-dimethylindol-2-yl)-3H-2-benzofuran-1-oneDTXSID80287751NSC-52367AKOS030617909
Database identifiers
- CAS
6951-67-3- PubChem CID
- 243124
- DTXSID
DTXSID80287751
Properties
Computed structural propertiesFilling in
- XLogP
- 3.5
- Topological polar surface area
- 31.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 423
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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