Basic information
- CAS
586-22-1- Standard SMILES
CCC(=O)c1ccc(OC)c(F)c1- InChIKey
SQXQCZIODUUTAD-UHFFFAOYSA-N- Molecular formula
- C10H11FO2
- Average molar mass
- 182.19 g/mol
- Monoisotopic mass
- 182.07430775
Names & identifiers
- Preferred name
- 1-(3-Fluoro-4-methoxyphenyl)propan-1-one
- IUPAC
- 1-(3-fluoro-4-methoxyphenyl)propan-1-one
- English name
- 3-fluoro-4-methoxypropiophenone
- Molecular formula
- C10H11FO2
- Molecular weight
- 182.19
Names & synonyms
586-22-11-(3-fluoro-4-methoxyphenyl)propan-1-one3-fluoro-4-methoxypropiophenone3'-Fluoro-4'-methoxypropiophenone1-(3-FLUORO-4-METHOXYPHENYL)-1-PROPANONEMFCD01814881NSC123876Bionet2_000494SCHEMBL2845183DTXSID00298526SQXQCZIODUUTAD-UHFFFAOYSA-NHMS1365G10
Show more names
1-(3-Fluoro-4-methoxyphenyl)3-Fluoro-4-methoxypropylphenone1-Propanone, 1-(3-fluoro-4-Methoxyphenyl)-1-(3-Fluoro-4-methoxyphenyl)propan-1-one, 2-Fluoro-4-propanoylanisole
CL9681SBB089899AKOS000346065NSC-123876YH2059741-(3-fluoro-4-methoxy-phenyl)propan-1-oneCS-011718312N-239
Database identifiers
- CAS
586-22-1- PubChem CID
- 276284
- DTXSID
DTXSID00298526- EC Number
- 611-720-5
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 182
Physicochemical properties
- Melting point
- 83 · 83-85 °C
- Boiling point
- 278.5 · 278.5±20.0 °C(Predicted)
- Density
- 1.099 · 1.099±0.06 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P305+P351+P338
- HS Code
- 2914409000 · 2914409000
Safety & regulation
Safety data
- hs_code
- 2914409000
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Preparation methods
PreparationObtained by reaction of propionyl chloride or propionic anhydride with 2-fluoroanisole in the presence of aluminium chloride in carbon disulfide.
Upstream & downstream products
Upstream raw materials
Suppliers20 total
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
Aladdin Scientific[email protected]
Allfluoro Pharmaceutical Company Limited+86-400-0216110 +86-15958047586 · [email protected]
常州安轩化工有限公司13912302692 · [email protected]
上海安米克化学品有限公司微信 17321281695 18019252918 · [email protected]
Aceschem Inc.+1-817863-6948 +1-（817）863-6948 · [email protected]
北京蓝博特科技有限公司010-56330744 18310155299 · [email protected]
武汉德拜技术有限公司18086626237 18086626237 · [email protected]
江西弗莱医药科技有限公司15870833005 · [email protected]
盐城康迪森医药科技有限公司13812573443;18052965989 · [email protected]
Guangzhou Yuheng Pharmaceutical Technology Co., Ltd+8613580539051 · [email protected]
上海麦克林生化科技股份有限公司50706066 15221275939 · [email protected]
江苏艾康生物医药研发有限公司025-58859352 13913916777 · [email protected]
常州安赛普化工有限公司0519-86305871 13961213398 · [email protected]
Changzhou Ansciep Chemical Co., Ltd.+86 519 86305871 · [email protected]
上海蓝乐鸟实业有限公司15021845385 · [email protected]
Aromsyn Co., Ltd.+86-0571-85585865 +86-13336024896 · [email protected]
南京康满林化工实业有限公司025-83697070 13770331960 · [email protected]
珠海奥博凯生物医药技术有限公司400-0628126 · [email protected]
Hefei TNJ Chemical Industry Co.,Ltd.+86-0551-65418671 +86-189 4982 3763 · [email protected]
Related reactions
2 records
Compound notes
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