Basic information
- CAS
64287-19-0- Standard SMILES
COc1cc(C(C)=O)ccc1F- InChIKey
PFEGFUCYOHBDJF-UHFFFAOYSA-N- Molecular formula
- C9H9FO2
- Average molar mass
- 168.16 g/mol
- Monoisotopic mass
- 168.05865775
Names & identifiers
- Preferred name
- 1-(4-Fluoro-3-methoxyphenyl)ethanone
- IUPAC
- 1-(4-fluoro-3-methoxyphenyl)ethanone
- English name
- 4-Fluoro-3-methoxyacetophenone
- Molecular formula
- C9H9FO2
- Molecular weight
- 168.16
Names & synonyms
64287-19-01-(4-fluoro-3-methoxyphenyl)ethanone1-(4-Fluoro-3-methoxyphenyl)ethan-1-oneDTXSID40379080RefChem:425461DTXCID90330106613-561-74'-Fluoro-3'-methoxyacetophenone4-Fluoro-3-MethoxyacetophenoneMFCD00272135ethanone, 1-(4-fluoro-3-methoxyphenyl)-3-METHOXY-4-FLUOROACETOPHENONE
Show more names
4'-Fluoro-3'-methoxyacetophenone 98%4'-Fluoro-3'-methoxyacetophenone 99+%1-(4-Fluoro-3-methoxyphenyl)ethanone - [F93351]1-(4-Fluoro-3-methoxyphenyl)ethan-1-one, 5-Acetyl-2-fluoroanisole
SCHEMBL6609291-acetyl-4-fluoro-3-methoxybenzene1-(4-fluoro-3-methoxy-phenyl)ethanoneSCHEMBL29599043PFEGFUCYOHBDJF-UHFFFAOYSA-NCK2585SBB064944AKOS005063602
Database identifiers
- CAS
64287-19-0- PubChem CID
- 2774532
- DTXSID
DTXSID40379080- EC Number
- 613-561-7
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 170
Physicochemical properties
- Melting point
- 52 °C · 52 °C
- Boiling point
- 246 · 246.0±20.0 °C(Predicted)
- Density
- 1.127 · 1.127±0.06 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- Appearance
- Light yellow to green yellow Solid
- BRN
- 4381319 · 4381319
- CAS DataBase Reference
- 64287 · 64287-19-0(CAS DataBase Reference)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P280a-P304+P340-P305+P351+P338-P405-P501a
- Hazard Codes
- Xi,Xn
- Risk Statements
- 36 · 36/37/38-22
- Safety Statements
- 26 · 26-36
- Hazard Note
- Irritant
- HS Code
Safety & regulation
GHS classification
GHS Classification
Warning
H302 (12.5%): 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)
Aggregated GHS information provided per 8 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (12.5%)
Safety data
- hs_code
- 2914500090
- risk_code
- 36/37/38-22
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi,Xn
- hazard_note
- Irritant
- safety_code
- 26-36
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P261-P280a-P304+P340-P305+P351+P338-P405-P501a
Chemistry & industry
Applications
Uses4''-Fluoro-3''-methoxyacetophenone
Suppliers84 total
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
杭州鸿喜生物医药科技有限公司18989489206 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
Changzhou Anxuan Chemical Co., Ltd+86-0519-89882563 +86-18961279162 · [email protected]
武汉欣扬瑞和化学科技有限公司153-07155313 15307155313 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]
陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]
Nanjing Fred Technology Co., Ltd+86-25-84696168 +86-15380713688 · [email protected]
上海赫文斯化工有限公司15721252604 17321035817 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
Related reactions
8 records
Compound notes
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