2-Methyl-6-phenoxyquinolin-4-ol
Basic information
- CAS
56716-98-4- Standard SMILES
Cc1cc(=O)c2cc(Oc3ccccc3)ccc2[nH]1- InChIKey
ZBSNECQPGWJIGI-UHFFFAOYSA-N- Molecular formula
- C16H13NO2
- Average molar mass
- 251.28 g/mol
- Monoisotopic mass
- 251.09462866
Names & identifiers
- Preferred name
- 2-Methyl-6-phenoxyquinolin-4-ol
- IUPAC
- 2-methyl-6-phenoxy-1H-quinolin-4-one
- English name
- 2-methyl-6-phenoxyquinolin-4-ol
- Molecular formula
- C16H13NO2
- Molecular weight
- 251.28
Names & synonyms
2-methyl-6-phenoxyquinolin-4-ol56716-98-42-methyl-6-phenoxy-1H-quinolin-4-oneSCHEMBL3649291GCA71698AKOS002305476ST074482CS-0224607EN300-120121G535184-Quinolinol, 2-methyl-6-phenoxy-4-hydroxy-2-methyl-6-phenoxyquinoline
Database identifiers
- CAS
56716-98-4- PubChem CID
- 734518
- EC Number
- 156-208-8
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 371
Physicochemical properties
- Boiling point
- 429.1 · 429.1±40.0 °C(Predicted)
- Density
- 1.243 · 1.243±0.06 g/cm3(Predicted)
- pka
- 4.34 · 4.34±0.40(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
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
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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