Cas no 90272-96-1 (2-(5-(Chloromethyl)-1,2,4-oxadiazol-3-yl)phenol)

2-(5-(Chloromethyl)-1,2,4-oxadiazol-3-yl)phenol is a heterocyclic compound featuring a 1,2,4-oxadiazole core substituted with a chloromethyl group at the 5-position and a phenolic moiety at the 3-position. This structure confers unique reactivity, making it a versatile intermediate in organic synthesis, particularly for constructing pharmacologically active molecules or functional materials. The chloromethyl group offers a reactive site for further derivatization, enabling nucleophilic substitution or cross-coupling reactions. The phenolic hydroxyl group enhances solubility in polar solvents and provides an additional handle for modifications. Its balanced lipophilicity and electronic properties make it suitable for applications in medicinal chemistry, agrochemicals, and material science. The compound's stability under standard conditions ensures ease of handling and storage.
2-(5-(Chloromethyl)-1,2,4-oxadiazol-3-yl)phenol structure
90272-96-1 structure
Product Name:2-(5-(Chloromethyl)-1,2,4-oxadiazol-3-yl)phenol
CAS No:90272-96-1
MF:C9H7ClN2O2
MW:210.617080926895
MDL:MFCD07369928
CID:798186
PubChem ID:135741571
Update Time:2025-07-02

2-(5-(Chloromethyl)-1,2,4-oxadiazol-3-yl)phenol Chemical and Physical Properties

Names and Identifiers

    • 2-(5-(Chloromethyl)-1,2,4-oxadiazol-3-yl)phenol
    • 2-(5-Chloromethyl-[1,2,4]oxadiazol-3-yl)-phenol
    • Phenol,2-[5-(chloromethyl)-1,2,4-oxadiazol-3-yl]-
    • 1,2,4-Oxadiazole,3-(2-bromophenyl)-5-(chloromethyl)
    • 2-[5-(Chloromethyl)-1,2,4-Oxadiazol-3-Yl]-Phenol
    • 2-brom-phenyl>AGN-PC-003W40
    • 3-(2-bromo-phenyl)-5-chloromethyl-[1,2,4]oxadiazole
    • 5-Chlormethyl-3-<2-hydroxy-phenyl>-1,2,4-oxadiazol
    • Q-102367
    • 2-[5-(CHLOROMETHYL)-1,2,4-OXADIAZOL-3-YL]PHENOL
    • AS-76420
    • MFCD07369928
    • FT-0687241
    • (6E)-6-[5-(chloromethyl)-1,2,4-oxadiazol-3-ylidene]cyclohexa-2,4-dien-1-one
    • 90272-96-1
    • DB-012318
    • MDL： MFCD07369928
    • Inchi： 1S/C9H7ClN2O2/c10-5-8-11-9(12-14-8)6-3-1-2-4-7(6)13/h1-4,13H,5H2
    • InChI Key： JWQIETXHXBMYPY-UHFFFAOYSA-N
    • SMILES： ClCC1=NC(C2C=CC=CC=2O)=NO1

Computed Properties

  • Exact Mass: 210.02000
  • Monoisotopic Mass: 210.02
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 394
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 1
  • Topological Polar Surface Area: 50.7A^2
  • XLogP3: 1.9

Experimental Properties

  • Color/Form: White to Yellow Solid
  • Density: 1.403
  • Boiling Point: 367.2°Cat760mmHg
  • Flash Point: 175.9°C
  • Refractive Index: 1.594
  • PSA: 59.15000
  • LogP: 2.18100

2-(5-(Chloromethyl)-1,2,4-oxadiazol-3-yl)phenol Security Information

2-(5-(Chloromethyl)-1,2,4-oxadiazol-3-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%

2-(5-(Chloromethyl)-1,2,4-oxadiazol-3-yl)phenol Pricemore >>

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SHANG HAI BI DE YI YAO KE JI GU FEN Co., Ltd.
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SHANG HAI BI DE YI YAO KE JI GU FEN Co., Ltd.
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SHANG HAI BI DE YI YAO KE JI GU FEN Co., Ltd.
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Ambeed
A876953-250mg
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Ambeed
A876953-1g
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 90272-96-1 97%
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 $140.0 2025-04-15

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