Cas no 876710-49-5 (5-(3,4-Dichlorophenyl)-1,2-oxazole-3-carboxylic Acid)

5-(3,4-Dichlorophenyl)-1,2-oxazole-3-carboxylic Acid structure
876710-49-5 structure
Product Name:5-(3,4-Dichlorophenyl)-1,2-oxazole-3-carboxylic Acid
CAS No:876710-49-5
MF:C10H5Cl2NO3
MW:258.057600736618
MDL:MFCD07186353
CID:892550
PubChem ID:3157099
Update Time:2024-10-26

5-(3,4-Dichlorophenyl)-1,2-oxazole-3-carboxylic Acid Chemical and Physical Properties

Names and Identifiers

    • 5-(3,4-DICHLORO-PHENYL)-ISOXAZOLE-3-CARBOXYLIC ACID
    • 5-(3,4-dichlorophenyl)-1,2-oxazole-3-carboxylic acid
    • 5-(3,4-dichlorophenyl)-3-Isoxazolecarboxylic acid
    • 5-(3,4-Dichlorophenyl)-3-isoxazolecarboxylic acid (ACI)
    • SY267663
    • 876710-49-5
    • AKOS000141153
    • F88152
    • 5-(3,4-dichlorophenyl)isoxazole-3-carboxylicacid
    • 5-(3,4-dichlorophenyl)isoxazole-3-carboxylic acid
    • DTXSID40390098
    • BKB71049
    • MFCD07186353
    • 5-(3,4-Dichlorophenyl)-1,2-oxazole-3-carboxylic Acid
    • MDL： MFCD07186353
    • Inchi： 1S/C10H5Cl2NO3/c11-6-2-1-5(3-7(6)12)9-4-8(10(14)15)13-16-9/h1-4H,(H,14,15)
    • InChI Key： GJJPRTBPAZSUJZ-UHFFFAOYSA-N
    • SMILES： O=C(C1C=C(C2C=C(Cl)C(Cl)=CC=2)ON=1)O

Computed Properties

  • Exact Mass: 256.96500
  • Monoisotopic Mass: 256.965
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 2
  • Complexity: 277
  • 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
  • XLogP3: 3.1
  • Topological Polar Surface Area: 63.3?2

Experimental Properties

  • PSA: 63.33000
  • LogP: 3.34660

5-(3,4-Dichlorophenyl)-1,2-oxazole-3-carboxylic Acid Security Information

  • Hazardous Material Identification： Xi
  • HazardClass：IRRITANT

5-(3,4-Dichlorophenyl)-1,2-oxazole-3-carboxylic Acid Customs Data

  • HS CODE：2934999090
  • Customs Data：

    China Customs Code:

    2934999090

    Overview:

    2934999090. Other heterocyclic compounds. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

5-(3,4-Dichlorophenyl)-1,2-oxazole-3-carboxylic Acid Pricemore >>

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5-(3,4-Dichlorophenyl)-1,2-oxazole-3-carboxylic Acid Production Method

Production Method 1

Reaction Conditions
1.1 Reagents: Sodium hydroxide Solvents: Tetrahydrofuran ,  Water ;  1 h, 60 °C
Reference
Synthesis and anticancer activity of heteroaromatic linked 4β-amido podophyllotoxins as apoptotic inducing agents
Kamal, Ahmed; et al, Bioorganic & Medicinal Chemistry Letters, 2013, 23(1), 273-280

Production Method 2

Reaction Conditions
1.1 Reagents: Hydroxyamine hydrochloride Solvents: Methanol ;  3 h, reflux
2.1 Reagents: Sodium hydroxide Solvents: Tetrahydrofuran ,  Water ;  1 h, 60 °C
Reference
Synthesis and anticancer activity of heteroaromatic linked 4β-amido podophyllotoxins as apoptotic inducing agents
Kamal, Ahmed; et al, Bioorganic & Medicinal Chemistry Letters, 2013, 23(1), 273-280

Production Method 3

Reaction Conditions
1.1 Reagents: Sodium methoxide Solvents: Tetrahydrofuran ;  8 h, rt
2.1 Reagents: Hydroxyamine hydrochloride Solvents: Methanol ;  3 h, reflux
3.1 Reagents: Sodium hydroxide Solvents: Tetrahydrofuran ,  Water ;  1 h, 60 °C
Reference
Synthesis and anticancer activity of heteroaromatic linked 4β-amido podophyllotoxins as apoptotic inducing agents
Kamal, Ahmed; et al, Bioorganic & Medicinal Chemistry Letters, 2013, 23(1), 273-280

5-(3,4-Dichlorophenyl)-1,2-oxazole-3-carboxylic Acid Raw materials

5-(3,4-Dichlorophenyl)-1,2-oxazole-3-carboxylic Acid Preparation Products

5-(3,4-Dichlorophenyl)-1,2-oxazole-3-carboxylic Acid Related Literature

876710-49-5 (5-(3,4-Dichlorophenyl)-1,2-oxazole-3-carboxylic Acid) Related Products

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