4H-1-Benzopyran-4-one, 7-hydroxy-3-phenoxy-
Basic information
- CAS
87891-60-9- Standard SMILES
O=c1c(Oc2ccccc2)coc2cc(O)ccc12- InChIKey
RQYBXCFFANHJGM-UHFFFAOYSA-N- Molecular formula
- C15H10O4
- Average molar mass
- 254.24 g/mol
- Monoisotopic mass
- 254.0579088
Names & identifiers
- Preferred name
- 4H-1-Benzopyran-4-one, 7-hydroxy-3-phenoxy-
- IUPAC
- 7-hydroxy-3-phenoxychromen-4-one
- English name
- 7-hydroxy-3-phenoxychromen-4-one
- Molecular formula
- C15H10O4
- Molecular weight
- 254.24
Names & synonyms
7-hydroxy-3-phenoxy-4H-chromen-4-one87891-60-94H-1-Benzopyran-4-one, 7-hydroxy-3-phenoxy-3-Phenoxy-7-hydroxychromone7-Hydroxy-3-phenoxy-4H-1-benzopyran-4-oneBRN 4190789DTXSID60236681RefChem:527346DTXCID90159172976-248-77-hydroxy-3-phenoxychromen-4-oneCambridge id 5320369
Show more names
7-hydroxy-3-phenoxychromoneOprea1_364890Oprea1_837998IFLab1_000609SCHEMBL18550765HMS1413L15MDA89160STL513006
Database identifiers
- CAS
87891-60-9- PubChem CID
- 5338633
- DTXSID
DTXSID60236681- EC Number
- 976-248-7
- Nikkaji
- J270.637G
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 370
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%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…