Basic information
- CAS
55258-76-9- Standard SMILES
CCc1ccc(-c2ccccc2)c(F)c1- InChIKey
GEBUSPQBSWYLBN-UHFFFAOYSA-N- Molecular formula
- C14H13F
- Average molar mass
- 200.25 g/mol
- Monoisotopic mass
- 200.10012858
Names & identifiers
- Preferred name
- 4-Ethyl-2-fluoro-1,1'-biphenyl
- IUPAC
- 4-ethyl-2-fluoro-1-phenylbenzene
- English name
- 4-Ethyl-2-fluoro-1,1'-biphenyl
- Molecular formula
- C14H13F
- Molecular weight
- 200.25
Names & synonyms
4-ethyl-2-fluoro-1,1'-biphenyl55258-76-9G2S8KN8ZB7DTXSID80363423RefChem:1070632DTXCID803144701,1'-Biphenyl, 4-ethyl-2-fluoro-4-ethyl-2-fluoro-1-phenylbenzene4-Ethyl-2-fluorobiphenylC14H13FFlurbiprofen Impurity 4Flurbiprofen Impurity 12
Show more names
Flurbiprofen EP ImpurityFlurbiprofen EP Impurity FFlurbiprofen Related Impurity4-ethyl-2-fluoro-l-phenylbenzene4-ethyl-2-fluoro-1,1-biphenyl(Flurbiprofen EP Impurity F)
FLURBIPROFEN IMPURITY 64-ethyl-2-fluoro-1-phenyl-benzeneFlurbiprofen Impurity G2-fluoro-4-ethylbiphenyl4-Ethyl-2-fluoro-biphenylSCHEMBL457978SCHEMBL3776825SCHEMBL3776828
Database identifiers
- CAS
55258-76-9- PubChem CID
- 1490326
- DTXSID
DTXSID80363423- UNII
- G2S8KN8ZB7
- Nikkaji
- J425.321C
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 0 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 184
Physicochemical properties
- Boiling point
- 276.8 · 276.8±19.0 °C(Predicted)
- Density
- 1.044 · 1.044±0.06 g/cm3(Predicted)
- storage temp.
- Store at room temperature
- Appearance
- Colorless to light yellow Liquid
- InChI
- InChI=1S/C14H13F/c1-2-11-8-9-13(14(15)10-11)12-6-4-3-5-7-12/h3-10H,2H2,1H3
- InChIKey
- GEBUSPQBSWYLBN-UHFFFAOYSA-N
- SMILES
- C1(C2=CC=CC=C2)=CC=C(CC)C=C1F
Chemistry & industry
Applications
Uses4-Ethyl-2-fluoro-1,1''-biphenyl is a photoproduct of Flurbiprofen (F598700), an anti-inflammatory used as an analgesic.
Suppliers76 total
陕西缔都医药有限责任公司029-81124775 17791530730 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
济南百隆化学有限公司[email protected] · [email protected]
武汉英诺医药科技有限公司+86-027-59232304 15387063101 · [email protected]
武汉敬康恩生物医药科技有限公司13720134139 086-15871494362 13720134139 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
武汉卓元易创科技有限公司13476791851 13476791851 · [email protected]
广州隽沐生物科技股份有限公司020-36607679; 13502246435 · [email protected]
湖北科乐精细化工有限公司027-59101668 19945030958 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
希瓦生物科技（广州）有限公司13268215580 · [email protected]
Related reactions
6 records
Compound notes
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