Indolin-1-yl(5-methylisoxazol-3-yl)methanone
Basic information
- CAS
830339-85-0- Standard SMILES
Cc1cc(C(=O)N2CCc3ccccc32)no1- InChIKey
YOYYKSJJIWTDRV-UHFFFAOYSA-N- Molecular formula
- C13H12N2O2
- Average molar mass
- 228.25 g/mol
- Monoisotopic mass
- 228.08987763
Names & identifiers
- Preferred name
- Indolin-1-yl(5-methylisoxazol-3-yl)methanone
- IUPAC
- 2,3-dihydroindol-1-yl-(5-methyl-1,2-oxazol-3-yl)methanone
- English name
- Methanone, (2,?3-?dihydro-?1H-?indol-?1-?yl)?(5-?methyl-?3-?isoxazolyl)?-
- Molecular formula
- C13H12N2O2
- Molecular weight
- 228.25
Names & synonyms
830339-85-0Indolin-1-yl(5-methylisoxazol-3-yl)methanoneST50835351(2,3-DIHYDRO-1H-INDOL-1-YL)(5-METHYL-3-ISOXAZOLYL)-METHANONE1-(5-methyl-1,2-oxazole-3-carbonyl)-2,3-dihydro-1H-indole(2,3-Dihydro-1H-indol-1-yl)(5-methyl-1,2-oxazol-3-yl)methanoneHMS1597K042,3-dihydroindol-1-yl-(5-methyl-1,2-oxazol-3-yl)methanoneDTXSID10388023STK467375AKOS001088219indolinyl 5-methylisoxazol-3-yl ketone
Show more names
Methanone, (2,3-dihydro-1H-indol-1-yl)(5-methyl-3-isoxazolyl)-
1-[(5-methyl-3-isoxazolyl)carbonyl]indolineSR-01000068013SR-01000068013-1Z306229312,3-dihydro-1H-indol-1-yl(5-methyl-1,2-oxazol-3-yl)methanone
Database identifiers
- CAS
830339-85-0- PubChem CID
- 2970533
- DTXSID
DTXSID10388023
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 46.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 308
Physicochemical properties
- Boiling point
- 422.6 · 422.6±45.0 °C(Predicted)
- Density
- 1.275 · 1.275±0.06 g/cm3(Predicted)
- pka
- 0.82 · 0.82±0.20(Predicted)
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…