Basic information
- CAS
203115-93-9- Standard SMILES
CC(C)Oc1cccc(F)c1- InChIKey
INDGWZOOYLDIPO-UHFFFAOYSA-N- Molecular formula
- C9H11FO
- Average molar mass
- 154.18 g/mol
- Monoisotopic mass
- 154.07939313
Names & identifiers
- Preferred name
- 1-Fluoro-3-isopropoxybenzene
- IUPAC
- 1-fluoro-3-propan-2-yloxybenzene
- English name
- 2-(3'-Fluorophenoxy)propane
- Molecular formula
- C9H11FO
- Molecular weight
- 154.18
Names & synonyms
1-Fluoro-3-isopropoxybenzene203115-93-91-fluoro-3-propan-2-yloxybenzene2-(3'-fluorophenoxy)propane2-(3-Fluorophenoxy)propaneBenzene, 1-fluoro-3-(1-methylethoxy)-1-Fluoro-3-(1-methylethoxy)benzene1-Fluoro-3-isopropoxy-benzeneMFCD000708003-fluoro-isopropoxy-benzeneSCHEMBL104732SCHEMBL162720
Show more names
1-Fluoro-3-isopropoxybenzene >=95%Benzene, 1-fluoro-3-(1-methylethoxy)- (9CI)
SCHEMBL1561305SCHEMBL3168184SCHEMBL4536424SCHEMBL4777768SCHEMBL9254323DTXSID903720813-fluoro-1-(methylethoxy)benzeneINDGWZOOYLDIPO-UHFFFAOYSA-N
Database identifiers
- CAS
203115-93-9- PubChem CID
- 2737460
- DTXSID
DTXSID90372081- EC Number
- 922-000-8
- Nikkaji
- J2.341.570D
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 114
Physicochemical properties
- Boiling point
- 171.9 · 171.9±13.0 °C(Predicted)
- Density
- 1.02 · 1.020±0.06 g/cm3(Predicted)
- form
- liquid
- InChI
- 1S/C9H11FO/c1-7(2)11-9-5-3-4-8(10)6-9/h3-7H,1-2H3
- InChIKey
- INDGWZOOYLDIPO-UHFFFAOYSA-N
- UNSPSC Code
- 12352200 · 12352200
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 26 · 26-36
- WGK Germany
- 3 · WGK 3
- Hazard Note
- Irritant
- HS Code
- 2909309090 · 2909309090
- Storage Class
- 10 · 10 - Combustible liquids
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
- wgk
- WGK 3
- hs_code
- 2909309090
- risk_code
- 36/37/38
- hazard_code
- Xi
- hazard_note
- Irritant
- safety_code
- 26-36
- Storage Class
- 10 - Combustible liquids
Chemistry & industry
Applications
Uses1-Fluoro-3-isopropoxybenzene is a versatile building block for the preparation of ligands such as EPhos, piperidinemethanols, and functionalized xanthones.
Suppliers17 total
上海凌富药物研究有限公司+86(21)5895 0110 19945755304 · [email protected]
上海凌凯科技股份有限公司58950110 13124863828 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
烟台盛凯伦生物制品有限公司13356901049 · [email protected]
无锡丽恒昇生物医药科技有限公司15250805028 15250805028 · [email protected]
江苏艾康生物医药研发有限公司025-66113011 13913916777 · [email protected]
北京福源坊科技有限公司010-57903446 15869909019 · [email protected]
Sigma-Aldrich西格玛奥德里奇(上海)贸易有限公司021-61415566 800-8193336 · [email protected]
聊城莱博特生物医药科技有限公司0635-893290 · [email protected]
上海颖心实验室设备有限公司021-021-59178156 15300768757 · [email protected]
南京雅科伦医药科技有限公司025-66096098 3165145969 · [email protected]
Related reactions
2 records
Compound notes
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