Cas no 1006-67-3 (5-Phenylisoxazole)

5-Phenylisoxazole structure
5-Phenylisoxazole structure
Product Name:5-Phenylisoxazole
CAS No:1006-67-3
MF:C9H7NO
MW:145.157982110977
MDL:MFCD00090038
CID:202384
PubChem ID:136800
Update Time:2025-04-19

5-Phenylisoxazole Chemical and Physical Properties

Names and Identifiers

    • Isoxazole, 5-phenyl-
    • 5-Phenylisoxazole
    • 1-(Isoxazol-5-yl)benzene
    • 5-Phenyl-1,2-oxazol
    • 5-Phenyl-isooxazol
    • 5-Phenyl-isoxazol
    • 5-Phenylisoxazol (III)
    • 5-Phenyl-isoxazole
    • Isoxazole,5-phenyl
    • BUTTPARK 81\09-55
    • 5-Phenyl-1,2-oxazole
    • DTXSID20143423
    • T71521
    • 1006-67-3
    • CS-0034428
    • FT-0620763
    • BDBM50078826
    • EN300-123975
    • MFCD00090038
    • CHEMBL81948
    • 5-Phenylisoxazol
    • PS-4277
    • NSC195338
    • 5-Phenylisoxazole, AldrichCPR
    • NSC-195338
    • NSC 195338
    • AKOS009158038
    • SY050781
    • SCHEMBL136631
    • BXQDLEHCXQQSCH-UHFFFAOYSA-N
    • P2309
    • DB-058473
    • DTXCID7065914
    • MDL: MFCD00090038
    • Inchi: 1S/C9H7NO/c1-2-4-8(5-3-1)9-6-7-10-11-9/h1-7H
    • InChI Key: BXQDLEHCXQQSCH-UHFFFAOYSA-N
    • SMILES: O1C(=CC=N1)C1C=CC=CC=1

Computed Properties

  • Exact Mass: 145.05300
  • Monoisotopic Mass: 145.052763847g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 1
  • Complexity: 121
  • 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: 2
  • Topological Polar Surface Area: 26?2

Experimental Properties

  • Melting Point: 22°C(lit.)
  • Boiling Point: 260°C(lit.)
  • PSA: 26.03000
  • LogP: 2.34160
  • λmax: 260(EtOH)(lit.)

5-Phenylisoxazole Security Information

  • Hazard Statement: Irritant
  • Hazard Category Code: 22
  • Hazardous Material Identification: Xi

5-Phenylisoxazole 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-Phenylisoxazole Pricemore >>

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5-Phenylisoxazole Production Method

5-Phenylisoxazole Related Literature

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