6-Iodochroman-4-one
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Basic information
- CAS
101714-35-6- Standard SMILES
O=C1CCOc2ccc(I)cc21- InChIKey
SDUOLEARZNZVAN-UHFFFAOYSA-N- Molecular formula
- C9H7IO2
- Average molar mass
- 274.05 g/mol
- Monoisotopic mass
- 273.94908
Names & identifiers
- Preferred name
- 6-Iodochroman-4-one
- IUPAC
- 6-iodo-2,3-dihydrochromen-4-one
- English name
- 6-IODOCHROMAN-4-ONE
- Molecular formula
- C9H7IO2
- Molecular weight
- 274.06
Names & synonyms
6-iodochroman-4-one101714-35-6DTXSID40393842RefChem:308650DTXCID303447026-iodo-2,3-dihydrochromen-4-one4H-1-Benzopyran-4-one, 2,3-dihydro-6-iodo-MFCD013190186-Iodo-2,3-dihydro-4H-1-benzopyran-4-one6-IODO-2,3-DIHYDRO-4H-BENZOPYRAN-4-ONESCHEMBL67612SDUOLEARZNZVAN-UHFFFAOYSA-N
Show more names
AKOS009328865AB088406-iodo-2,3-dihydro-4H-chromen-4-oneBS-19117DA-36105SY041385CS-0155728F11200
Database identifiers
- CAS
101714-35-6- PubChem CID
- 3580262
- DTXSID
DTXSID40393842- Nikkaji
- J811.874D
Properties
Computed structural propertiesFilling in
- XLogP
- 2
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 193
Physicochemical properties
- Boiling point
- 357.7 · 357.7±42.0 °C(Predicted)
- Density
- 1.878 · 1.878±0.06 g/cm3(Predicted)
- storage temp.
- Keep in dark place,Sealed in dry,Room Temperature
- Appearance
- White to light brown Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319
- Precautionary statements
- 261 · P261-P302+P352-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.
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319
- Precautionary statements
- P261-P302+P352-P305+P351+P338
Related reactions
8 records
Compound notes
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