Basic information
- CAS
188826-32-6- Standard SMILES
O=C1CCOc2cccc(F)c21- InChIKey
AVJVYZBPSAQLLA-UHFFFAOYSA-N- Molecular formula
- C9H7FO2
- Average molar mass
- 166.15 g/mol
- Monoisotopic mass
- 166.04300762
Names & identifiers
- Preferred name
- 5-Fluoro-4-Chromanone
- IUPAC
- 5-fluoro-2,3-dihydrochromen-4-one
- English name
- 5-Fluoro-4-chromanone
- Molecular formula
- C9H7FO2
- Molecular weight
- 166.15
Names & synonyms
5-Fluoro-4-Chromanone188826-32-65-Fluorochroman-4-one4H-1-Benzopyran-4-one, 5-fluoro-2,3-dihydro-5-fluoro-2,3-dihydrochromen-4-oneMFCD097439925-fluoro-3,4-dihydro-2H-1-benzopyran-4-one5-fluoro-chroman-4-oneSCHEMBL769070DTXSID60670460AVJVYZBPSAQLLA-UHFFFAOYSA-N(S)-2-(2-isopropoxyphenyl)piperidine
Show more names
AKOS0063318765-fluoro-2,3-dihydro-4h-chromen-4-oneAS-31261SY022041DB-065663CS-01466085-Fluoro-2,3-dihydro-4H-1-benzopyran-4-oneF241880
Database identifiers
- CAS
188826-32-6- PubChem CID
- 45489795
- DTXSID
DTXSID60670460
Properties
Computed structural properties
- XLogP
- 1.5
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 193
Physicochemical properties
- Boiling point
- 280 · 280.0±40.0 °C(Predicted)
- Density
- 1.297 · 1.297±0.06 g/cm3(Predicted)
- storage temp.
- Store at room temperature
- Appearance
- White to off-white Solid
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- HS Code
- 2932990090 · 2932990090
Safety & regulation
Safety data
- hs_code
- 2932990090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Suppliers47 total
上海康恩博医药科技有限公司17510465506 · [email protected]
河北凡博医药科技有限公司15588346797
上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
Sichuan Biosynce Pharmatech Co., Ltd.[email protected]
上海毕得医药科技股份有限公司400-1647117 13681763483 · [email protected]
北京依凯诺医药技术开发有限公司18518619637 · [email protected]
石家庄衍晟生物科技有限公司18332018567; 18332018567 · [email protected]
上海辅欣医药科技有限公司+86-021-021-50872116 · [email protected]
河南阿尔法化工有限公司0371-55013243 15324716602 · [email protected]
上海源鼎化学科技有限公司21-57721279 18121011378 · [email protected]
成都海品信医药科技有限公司85114309 18982182443 · [email protected]
台州南峰药物研究所[email protected] 18616377689 · [email protected]
越林试剂021-62960152 · [email protected]
Related reactions
2 records
Compound notes
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