2-Indolinone, 3,3-bis(2-hydroxypropyl)-1-phenyl-
Basic information
- CAS
20870-64-8- Standard SMILES
CC(O)CC1(CC(C)O)C(=O)N(c2ccccc2)c2ccccc21- InChIKey
ANXFYQLOZMIJFZ-UHFFFAOYSA-N- Molecular formula
- C20H23NO3
- Average molar mass
- 325.4 g/mol
- Monoisotopic mass
- 325.1677936
Names & identifiers
- Preferred name
- 2-Indolinone, 3,3-bis(2-hydroxypropyl)-1-phenyl-
- IUPAC
- 3,3-bis(2-hydroxypropyl)-1-phenylindol-2-one
Names & synonyms
20870-64-82-INDOLINONE, 3,3-BIS(2-HYDROXYPROPYL)-1-PHENYL-RefChem:10635113,3-Bis(2-hydroxypropyl)-1-phenylindolin-2-one3,3-Bis(2-hydroxypropyl)-1-phenyl-2-indolinoneBRN 1593699N-Phenyl-3,3-di(beta-hydroxypropyl)oxoindoleDTXSID609431265-21-13-00109 (Beilstein Handbook Reference)3,3-Bis(2-hydroxypropyl)-1-phenyl-1,3-dihydro-2H-indol-2-one
Database identifiers
- CAS
20870-64-8- PubChem CID
- 30335
- DTXSID
DTXSID60943126
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 60.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 436
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Compound notes
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