Alpha-(3-hydroxy-2-oxo-3-indolinyl)-2-methylpyridine
Basic information
- CAS
6299-00-9- Standard SMILES
O=C1Nc2ccccc2C1(O)Cc1ccccn1- InChIKey
NGKGBFMNFGPGGV-UHFFFAOYSA-N- Molecular formula
- C14H12N2O2
- Average molar mass
- 240.26 g/mol
- Monoisotopic mass
- 240.08987763
Names & identifiers
- Preferred name
- Alpha-(3-hydroxy-2-oxo-3-indolinyl)-2-methylpyridine
- IUPAC
- 3-hydroxy-3-(pyridin-2-ylmethyl)-1H-indol-2-one
- English name
- 3-hydroxy-3-(2-pyridinylmethyl)-1,3-dihydro-2H-indol-2-one
- Molecular formula
- C14H12N2O2
- Molecular weight
- 240.26
Names & synonyms
ALPHA-(3-HYDROXY-2-OXO-3-INDOLINYL)-2-METHYLPYRIDINERefChem:555216654-834-06299-00-9NSC424483-Hydroxy-3-(2-pyridylmethyl)-2-indolinone3-Hydroxy-3-(pyridin-2-ylmethyl)indolin-2-one3-hydroxy-3-(pyridin-2-ylmethyl)-1H-indol-2-oneMLS000737059NSC6316093-Hydroxy-3-(2-pyridinylmethyl)-1,3-dihydro-2H-indol-2-oneNSC 42448
Show more names
2H-Indol-2-one, 1,3-dihydro-3-hydroxy-3-(2-pyridinylmethyl)-
BRN 0210266NSC-424482-INDOLINONE, 3-HYDROXY-3-(2-PYRIDYLMETHYL)-alpha-(2-Oxo-3-hydroxy-indolinyl-(3))-2-methyl pyridineMaybridge1_006274Oprea1_0671994-25-00-00176 (Beilstein Handbook Reference)SCHEMBL734231
Database identifiers
- CAS
6299-00-9- PubChem CID
- 22733
- DTXSID
DTXSID201381499- ChEMBL
CHEMBL1902669- EC Number
- 654-834-0
- Nikkaji
- J3.089.018C
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 62.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 334
Physicochemical properties
- Melting point
- 172 · 172-174 °C(Solv: ethanol (64-17-5))
- Boiling point
- 487.3 · 487.3±45.0 °C(Predicted)
- Density
- 1.349 · 1.349±0.06 g/cm3(Predicted)
- pka
- 11.67 · 11.67±0.20(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 319 · H319
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesEye Irrit. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H319
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P
Related reactions
2 records
Compound notes
Loading…