Cas no 79887-15-3 (1-Butoxy-4-ethynylbenzene)

1-Butoxy-4-ethynylbenzene structure
1-Butoxy-4-ethynylbenzene structure
Product Name:1-Butoxy-4-ethynylbenzene
CAS No:79887-15-3
MF:C12H14O
MW:174.238963603973
CID:60149
PubChem ID:2775120
Update Time:2025-10-28

1-Butoxy-4-ethynylbenzene Chemical and Physical Properties

Names and Identifiers

    • 1-Butoxy-4-eth-1-ynylbenzene
    • 4-n-Butoxyphenylacetylene
    • 1-Butoxy-4-ethynylbenzene
    • 4-Butoxyethynylbenzene
    • 4-Butoxyphenylacetylene
    • 4-butyloxyphenylacetylene
    • 4-n-butyloxyphenylacetylene
    • FT-0607558
    • JMLXBCSKFMMFGF-UHFFFAOYSA-N
    • MS-22027
    • CS-0358123
    • MFCD00173878
    • AKOS006229413
    • Benzene,1-butoxy-4-ethynyl-
    • SCHEMBL1007565
    • DTXSID70379396
    • 79887-15-3
    • J-504473
    • SY046416
    • DB-075632
    • MDL: MFCD00173878
    • Inchi: 1S/C12H14O/c1-3-5-10-13-12-8-6-11(4-2)7-9-12/h2,6-9H,3,5,10H2,1H3
    • InChI Key: JMLXBCSKFMMFGF-UHFFFAOYSA-N
    • SMILES: O(C1C=CC(C#C)=CC=1)CCCC

Computed Properties

  • Exact Mass: 174.10400
  • Monoisotopic Mass: 174.104465066g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 4
  • Complexity: 169
  • 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: 3.4
  • Topological Polar Surface Area: 9.2?2

Experimental Properties

  • Density: 1.0±0.1 g/cm3
  • Boiling Point: 252.9±23.0 °C at 760 mmHg
  • Flash Point: 100.5±18.3 °C
  • PSA: 9.23000
  • LogP: 2.84680
  • Vapor Pressure: 0.0±0.5 mmHg at 25°C

1-Butoxy-4-ethynylbenzene Security Information

1-Butoxy-4-ethynylbenzene Customs Data

  • HS CODE:2909309090
  • Customs Data:

    China Customs Code:

    2909309090

    Overview:

    2909309090 Other aromatic ethers and their halogenated derivatives\sulfonation\Nitrated derivative(Including nitrosative derivatives).Regulatory conditions:nothing.VAT:17.0%.Tax refund rate:9.0%.MFN tariff:5.5%.general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2909309090 other aromatic ethers and their halogenated, sulphonated, nitrated or nitrosated derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0%

1-Butoxy-4-ethynylbenzene Pricemore >>

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