Cas no 863870-86-4 (2-Chloro-3-fluorophenol)

2-Chloro-3-fluorophenol structure
2-Chloro-3-fluorophenol structure
Product Name:2-Chloro-3-fluorophenol
CAS No:863870-86-4
MF:C6H4ClFO
MW:146.546764373779
MDL:MFCD08166413
CID:69075
PubChem ID:11205840
Update Time:2024-10-26

2-Chloro-3-fluorophenol Chemical and Physical Properties

Names and Identifiers

    • 2-Chloro-3-fluorophenol
    • Phenol, 2-chloro-3-fluoro-
    • 2-chloro-3-fluoro-phenol
    • PubChem9615
    • KSC447Q1D
    • YIENEZQWQPFHQN-UHFFFAOYSA-N
    • AS05465
    • 2-FLUORO-6-HYDROXYCHLOROBENZENE
    • MB05350
    • LS10193
    • CM11674
    • ST2416673
    • AB0027073
    • W8864
    • A19901
    • 870C864
    • 2-Chloro-3-fluorophenol (ACI)
    • DB-005215
    • 863870-86-4
    • MFCD08166413
    • SCHEMBL1262189
    • GS-4143
    • DTXSID20458625
    • SY030912
    • J-508658
    • AC-25970
    • AKOS006286231
    • CS-W004875
    • MDL： MFCD08166413
    • Inchi： 1S/C6H4ClFO/c7-6-4(8)2-1-3-5(6)9/h1-3,9H
    • InChI Key： YIENEZQWQPFHQN-UHFFFAOYSA-N
    • SMILES： FC1C(Cl)=C(O)C=CC=1

Computed Properties

  • Exact Mass: 145.99300
  • Monoisotopic Mass: 145.9934706g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 0
  • Complexity: 99.1
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: 3
  • XLogP3: 2.3
  • Topological Polar Surface Area: 20.2

Experimental Properties

  • Color/Form: No data avaiable
  • Density: 1.4±0.1 g/cm3
  • Melting Point: No data available
  • Boiling Point: 193.3°C at 760 mmHg
  • Flash Point: 70.7±21.8 °C
  • Refractive Index: 1.547
  • PSA: 20.23000
  • LogP: 2.18470
  • Vapor Pressure: No data available

2-Chloro-3-fluorophenol Security Information

2-Chloro-3-fluorophenol Customs Data

  • HS CODE：2908199090
  • Customs Data：

    China Customs Code:

    2908199090

    Overview:

    HS:2908199090 Derivatives of other phenols and phenolic alcohols containing only halogen substituents and their salts VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:5.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    HS: 2908199090. derivatives of polyphenols or phenol-alcohols containing only halogen substituents and their salts. VAT:17.0%. tax rebate rate:9.0%. supervision conditions:None. MFN tariff:5.5%. general tariff:30.0%

2-Chloro-3-fluorophenol Pricemore >>

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2-Chloro-3-fluorophenol Production Method

Production Method 1

Reaction Conditions
1.1 Reagents: N,N,N′,N′-Tetramethylethylenediamine ,  sec-Butyllithium Solvents: Hexane ,  Cyclohexane ;  2 h, -78 °C
1.2 30 min, -78 °C; -78 °C → rt
1.3 Reagents: Water ;  rt
2.1 Reagents: Sodium hydroxide Solvents: Ethanol ;  6 h, reflux
2.2 Reagents: Hydrochloric acid Solvents: Water ;  neutralized, rt
Reference
A New and Efficient Synthesis of 4-Functionalized Benzo[b]furans from 2,3-Dihalophenols
Sanz, Roberto; et al, Journal of Organic Chemistry, 2005, 70(16), 6548-6551

Production Method 2

Reaction Conditions
1.1 Reagents: Sodium hydroxide Solvents: Ethanol ;  6 h, reflux
1.2 Reagents: Hydrochloric acid Solvents: Water ;  neutralized, rt
Reference
A New and Efficient Synthesis of 4-Functionalized Benzo[b]furans from 2,3-Dihalophenols
Sanz, Roberto; et al, Journal of Organic Chemistry, 2005, 70(16), 6548-6551

Production Method 3

Reaction Conditions
1.1 Reagents: Butyllithium Solvents: Tetrahydrofuran ,  Hexane ;  10 min, -78 °C; -78 °C → rt; 30 min, rt
1.2 Solvents: Tetrahydrofuran ;  36 h, reflux
2.1 Reagents: N,N,N′,N′-Tetramethylethylenediamine ,  sec-Butyllithium Solvents: Hexane ,  Cyclohexane ;  2 h, -78 °C
2.2 30 min, -78 °C; -78 °C → rt
2.3 Reagents: Water ;  rt
3.1 Reagents: Sodium hydroxide Solvents: Ethanol ;  6 h, reflux
3.2 Reagents: Hydrochloric acid Solvents: Water ;  neutralized, rt
Reference
A New and Efficient Synthesis of 4-Functionalized Benzo[b]furans from 2,3-Dihalophenols
Sanz, Roberto; et al, Journal of Organic Chemistry, 2005, 70(16), 6548-6551

Production Method 4

Reaction Conditions
1.1 Reagents: 1,3-Dichloro-5,5-dimethylhydantoin Catalysts: 2-Propanamine, N-(1-methylethyl)-, hydrochloride (1:1) Solvents: Toluene ;  4 h, 0 °C
1.2 Reagents: Sodium sulfite Solvents: Water
Reference
Ammonium Salt-Catalyzed Highly Practical Ortho-Selective Monohalogenation and Phenylselenation of Phenols: Scope and Applications
Xiong, Xiaodong ; et al, ACS Catalysis, 2018, 8(5), 4033-4043

2-Chloro-3-fluorophenol Raw materials

2-Chloro-3-fluorophenol Preparation Products

2-Chloro-3-fluorophenol Related Literature

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