Cas no 158580-93-9 (3-Chloro-4-(trifluoromethoxy)benzoic acid)

3-Chloro-4-(trifluoromethoxy)benzoic acid structure
158580-93-9 structure
Product Name:3-Chloro-4-(trifluoromethoxy)benzoic acid
CAS No:158580-93-9
MF:C8H4ClF3O3
MW:240.563772201538
MDL:MFCD01631556
CID:91978
PubChem ID:2773845
Update Time:2025-09-19

3-Chloro-4-(trifluoromethoxy)benzoic acid Chemical and Physical Properties

Names and Identifiers

    • 3-Chloro-4-(trifluoromethoxy)benzoic acid
    • 3-Chloro-4-(trifluoromethoxy)benzouc acid
    • Benzoic acid, 3-chloro-4-(trifluoromethoxy)-
    • 3-chloro-4-trifluorobenzoic acid
    • 4-Carboxy-2-chloro-alpha,alpha,alpha-trifluoroanisole
    • 3-Chloro-4-(trifluoromethoxy)benzoic acid 97%
    • 3-CHLORO-4-(TRIFLUOROMETHOXY)BENZOIC ACID 97+%
    • 3-Chloro-4-(trifluoromethoxy)benzoicacid
    • 3-chloro-4-[(trifluoromethyl)oxy]benzoic acid
    • 3-CHLORO-4-TRIFLUOROMETHOXYBENZOIC ACID
    • PubChem10176
    • KSC498C2J
    • QGVQWEOEEXGRSD-UHFFFAOYSA-N
    • W
    • CL8081
    • SBB099318
    • WT1920
    • WT2101
    • VZ26603
    • SY017563
    • AB0030065
    • DB-0
    • FT-0689413
    • CS-0081118
    • EN300-198457
    • AKOS015909275
    • DTXSID30378744
    • AC-26029
    • SCHEMBL403102
    • J-512214
    • PS-7581
    • Benzoic acid,3-chloro-4-(trifluoromethoxy)-
    • 158580-93-9
    • A20238
    • 3-chloro-4-trifluorobenzoic acid;3-Chloro-4-(trifluoromethoxy)benzoic Acid
    • MFCD01631556
    • DB-006399
    • MDL： MFCD01631556
    • Inchi： 1S/C8H4ClF3O3/c9-5-3-4(7(13)14)1-2-6(5)15-8(10,11)12/h1-3H,(H,13,14)
    • InChI Key： QGVQWEOEEXGRSD-UHFFFAOYSA-N
    • SMILES： ClC1C=C(C(=O)O)C=CC=1OC(F)(F)F

Computed Properties

  • Exact Mass: 239.98000
  • Monoisotopic Mass: 239.98
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 2
  • Complexity: 244
  • 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: nothing
  • XLogP3: 4
  • Topological Polar Surface Area: 46.5

Experimental Properties

  • Density: 1.558±0.06 g/cm3 (20 oC 760 Torr),
  • Boiling Point: 258.9±35.0 oC (760 Torr),
  • Flash Point: 110.4±25.9 oC,
  • Refractive Index: 1.498
  • Solubility: Very slightly soluble (0.11 g/l) (25 o C),
  • PSA: 46.53000
  • LogP: 2.93680

3-Chloro-4-(trifluoromethoxy)benzoic acid Security Information

  • Hazardous Material Identification： Xi

3-Chloro-4-(trifluoromethoxy)benzoic acid Customs Data

  • HS CODE：2918990090
  • Customs Data：

    China Customs Code:

    2918990090

    Overview:

    2918990090. Other additional oxy carboxylic acids(Including anhydrides\Acyl halide\Peroxides, peroxyacids and derivatives of this tax number). VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2918990090. other carboxylic acids with additional oxygen function and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

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3-Chloro-4-(trifluoromethoxy)benzoic acid Suppliers

Amadis Chemical Company Limited
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(CAS:158580-93-9)3-Chloro-4-(trifluoromethoxy)benzoic acid
Order Number:A20238
Stock Status:in Stock
Quantity:100g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 04:09
Price ($):351.0
Tiancheng Chemical (Jiangsu) Co., Ltd
Gold Member
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(CAS:158580-93-9)3-氯-4-(三氟甲氧基)苯甲酸
Order Number:LE2891868
Stock Status:in Stock
Quantity:25KG,200KG,1000KG
Purity:99%
Pricing Information Last Updated:Friday, 20 June 2025 12:42
Price ($):discuss personally

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Amadis Chemical Company Limited
(CAS:158580-93-9)3-Chloro-4-(trifluoromethoxy)benzoic acid
A20238
Purity:99%
Quantity:100g
Price ($):351.0
Email
Tiancheng Chemical (Jiangsu) Co., Ltd
(CAS:158580-93-9)3-氯-4-(三氟甲氧基)苯甲酸
LE2891868
Purity:99%
Quantity:25KG,200KG,1000KG
Price ($):Inquiry
Email