Cas no 96740-92-0 (2-Fluoro-4-hydroxybenzenemethanol)

2-Fluoro-4-hydroxybenzenemethanol structure
96740-92-0 structure
Product Name:2-Fluoro-4-hydroxybenzenemethanol
CAS No:96740-92-0
MF:C7H7FO2
MW:142.127685785294
MDL:MFCD06797932
CID:1083522
PubChem ID:53939912
Update Time:2024-10-25

2-Fluoro-4-hydroxybenzenemethanol Chemical and Physical Properties

Names and Identifiers

    • 3-Fluoro-4-(hydroxymethyl)phenol
    • 2-Fluoro-4-hydroxybenzenemethanol
    • BENZENEMETHANOL,2-FLUORO-4-HYDROXY-
    • 2-fluoro-4-hydroxybenzoic acid methyl ester
    • 2-fluoro-4-hydroxybenzyl alcohol
    • 2-fluoro-4-hyroxybenzoic acid methyl ester
    • methyl 2-fluoro-4-hydroxy-benzoate
    • IXBHZARBEOBOTB-UHFFFAOYSA-N
    • Benzenemethanol, 2-fluoro-4-hydroxy-
    • ST24042162
    • Y4866
    • 2-Fluoro-4-hydroxybenzenemethanol (ACI)
    • MFCD06797932
    • 96740-92-0
    • AKOS006286505
    • DA-40007
    • CS-0097973
    • SCHEMBL2898583
    • AS-33255
    • J-512472
    • MDL: MFCD06797932
    • Inchi: 1S/C7H7FO2/c8-7-3-6(10)2-1-5(7)4-9/h1-3,9-10H,4H2
    • InChI Key: IXBHZARBEOBOTB-UHFFFAOYSA-N
    • SMILES: FC1C(CO)=CC=C(O)C=1

Computed Properties

  • Exact Mass: 142.04300
  • Monoisotopic Mass: 142.04300762g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 1
  • Complexity: 108
  • 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
  • Topological Polar Surface Area: 40.5
  • XLogP3: 0.8

Experimental Properties

  • PSA: 40.46000
  • LogP: 1.02360

2-Fluoro-4-hydroxybenzenemethanol 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-Fluoro-4-hydroxybenzenemethanol Pricemore >>

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2-Fluoro-4-hydroxybenzenemethanol Production Method

Production Method 1

Reaction Conditions
1.1 Reagents: Lithium aluminum hydride Solvents: Tetrahydrofuran ;  45 min, rt
1.2 Reagents: Ethyl acetate ,  Hydrochloric acid ,  Water
Reference
Synthesis and structure-activity relationship studies of derivatives of the dual aromatase-sulfatase inhibitor 4-{[(4-cyanophenyl)(4H-1,2,4-triazol-4-yl)amino]methyl}phenyl sulfamate
Woo, L. W. Lawrence; Wood, Paul M.; Bubert, Christian; Thomas, Mark P.; Purohit, Atul; et al, ChemMedChem, 2013, 8(5), 779-799

Production Method 2

Reaction Conditions
1.1 Reagents: Sodium borohydride Solvents: Methanol ;  2 h, rt
Reference
Circumventing Seizure Activity in a Series of G Protein Coupled Receptor 119 (GPR119) Agonists
Scott, James S.; Bowker, Suzanne S.; Brocklehurst, Katy J.; Brown, Hayley S.; Clarke, David S.; et al, Journal of Medicinal Chemistry, 2014, 57(21), 8984-8998

Production Method 3

Reaction Conditions
1.1 Reagents: Lithium aluminum hydride Solvents: Tetrahydrofuran ;  0 °C; 3 h, 0 °C
1.2 Reagents: Sodium hydroxide Solvents: Ethyl acetate ,  Water ;  0 °C
Reference
Piperidine compound containing 1-oxido-thiazole moiety as GPR119 agonist and preparation method thereof
, Korea, , ,

Production Method 4

Reaction Conditions
1.1 Reagents: Lithium aluminum hydride Solvents: Tetrahydrofuran ;  0 °C; > 3 h, rt
Reference
Substituted piperidine derivatives as a GPR119 agonist useful in treatment of metabolism related diseases and their preparation
, World Intellectual Property Organization, , ,

Production Method 5

Reaction Conditions
1.1 Reagents: Sodium borohydride Solvents: Methanol ;  10 min, rt
Reference
Electronically modified polymer-supported cinchona phase-transfer catalysts for asymmetric synthesis of α-alkyl-α-amino acid derivatives
Shi, Qinghua; Lee, Yeon-Ju; Song, Hongrui; Cheng, Maosheng; Jew, Sang-sup; et al, Chemistry Letters, 2008, 37(4), 436-437

Production Method 6

Reaction Conditions
1.1 Reagents: (Dimethyl sulfide)trihydroboron Solvents: Tetrahydrofuran ;  rt
1.2 Reagents: Methanol
Reference
Compounds directed against pilus biogenesis and activity in pathogenic bacteria; methods and compositions for synthesis
, World Intellectual Property Organization, , ,

Production Method 7

Reaction Conditions
1.1 Reagents: Trimethyl borate Solvents: Tetrahydrofuran
1.2 Solvents: Methanol
Reference
Preparation of Fluorinated Linkers: Use of 19F NMR Spectroscopy to Establish Conditions for Solid-Phase Synthesis of Pilicide Libraries
Svensson, Anette; Fex, Tomas; Kihlberg, Jan, Journal of Combinatorial Chemistry, 2000, 2(6), 736-748

Production Method 8

Reaction Conditions
1.1 Reagents: Potassium hydroxide Solvents: Water ;  1 h, 60 °C
1.2 Solvents: Water ;  60 °C → 40 °C; 18 h, 40 °C; 40 °C → rt
1.3 Reagents: Hydrochloric acid Solvents: Water
Reference
Preparation of piperazines for treating disorders associated with the 5-HT2 receptor
, World Intellectual Property Organization, , ,

Production Method 9

Reaction Conditions
1.1 Reagents: Lithium aluminum hydride Solvents: Tetrahydrofuran ;  rt → 0 °C; 0 °C → rt; 3 h, rt
Reference
Piperazine derivative as GPR119 activator and method for the preparation thereof
, Korea, , ,

Production Method 10

Reaction Conditions
1.1 Reagents: Lithium aluminum hydride Solvents: Tetrahydrofuran ;  0 °C; > 3 h, rt
Reference
Preparation of substituted piperidine derivatives as GPR119 agonists
, Korea, , ,

Production Method 11

Reaction Conditions
Reference
Fluorinated linkers for monitoring solid-phase synthesis using gel-phase 19F NMR spectroscopy
Svensson, Anette; Bergquist, Karl-Erik; Fex, Tomas; Kihlberg, Jan, Tetrahedron Letters, 1998, 39(39), 7193-7196

2-Fluoro-4-hydroxybenzenemethanol Raw materials

2-Fluoro-4-hydroxybenzenemethanol Preparation Products

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