Cas no 86176-56-9 (4-Chloro-2-(isoxazol-5-yl)phenol)

4-Chloro-2-(isoxazol-5-yl)phenol structure
86176-56-9 structure
Product Name:4-Chloro-2-(isoxazol-5-yl)phenol
CAS No:86176-56-9
MF:C9H6ClNO2
MW:195.602441310883
MDL:MFCD00218660
CID:90935
PubChem ID:24870275
Update Time:2025-04-18

4-Chloro-2-(isoxazol-5-yl)phenol Chemical and Physical Properties

Names and Identifiers

    • 4-chloro-2-(5-isoxazolyl)phenol
    • 4-CHLORO-2-(ISOXAZOL-5-YL)PHENOL
    • 4-Chloro-2-isoxazol-5-ylphenol
    • 4-chloro-6-(2H-1,2-oxazol-5-ylidene)cyclohexa-2,4-dien-1-one
    • BDBM50534972
    • AKOS005175088
    • SCHEMBL2794646
    • MFCD00218660
    • AAJXJLYUWKMQNO-UHFFFAOYSA-N
    • AS-76197
    • CHEMBL4541308
    • 4-chloro-2-isoxazol-5-yl-phenol
    • FT-0683945
    • 4-Chloro-2-(5-isoxazolyl)phenol, 97%
    • 86176-56-9
    • CS-0043574
    • (6E)-4-chloro-6-(2H-1,2-oxazol-5-ylidene)cyclohexa-2,4-dien-1-one
    • 4-chloro-2-(1,2-oxazol-5-yl)phenol
    • ONR
    • Q27464153
    • DTXSID30425580
    • G84095
    • 5-(5'-Chloro-2'-hydroxyphenyl)-isoxazole
    • 4-Chloro-2-(isoxazol-5-yl)phenol
    • MDL: MFCD00218660
    • Inchi: 1S/C9H6ClNO2/c10-6-1-2-8(12)7(5-6)9-3-4-11-13-9/h1-5,12H
    • InChI Key: AAJXJLYUWKMQNO-UHFFFAOYSA-N
    • SMILES: ClC1C=CC(=C(C=1)C1=CC=NO1)O

Computed Properties

  • Exact Mass: 195.00900
  • Monoisotopic Mass: 195.0087061g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 179
  • 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: 2.3
  • Topological Polar Surface Area: 46.3?2

Experimental Properties

  • Color/Form: White to cream crystal powder
  • Density: 1.386
  • Melting Point: 196-200?°C (lit.)
  • Boiling Point: 353.989°C at 760 mmHg
  • Flash Point: 167.887°C
  • Refractive Index: 1.596
  • PSA: 46.26000
  • LogP: 2.70060
  • Solubility: Insoluble in water

4-Chloro-2-(isoxazol-5-yl)phenol Security Information

  • Symbol: GHS07
  • Signal Word:Warning
  • Hazard Statement: H315-H319-H335
  • Warning Statement: P261-P305+P351+P338
  • Hazardous Material transportation number:NONH for all modes of transport
  • WGK Germany:3
  • Hazard Category Code: 36/37/38
  • Safety Instruction: S26; S36
  • Hazardous Material Identification: Xi
  • Risk Phrases:R36/37/38
  • HazardClass:IRRITANT

4-Chloro-2-(isoxazol-5-yl)phenol 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%

4-Chloro-2-(isoxazol-5-yl)phenol Pricemore >>

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4-Chloro-2-(isoxazol-5-yl)phenol Production Method

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