Cas no 19781-33-0 (1-Phenyl-3-ethyl-1-heptyn-3-ol)

1-Phenyl-3-ethyl-1-heptyn-3-ol structure
19781-33-0 structure
Product Name:1-Phenyl-3-ethyl-1-heptyn-3-ol
CAS No:19781-33-0
MF:C15H20O
MW:216.318704605103
CID:88122
PubChem ID:20382016
Update Time:2025-04-18

1-Phenyl-3-ethyl-1-heptyn-3-ol Chemical and Physical Properties

Names and Identifiers

    • 1-Phenyl-3-ethyl-1-heptyn-3-ol
    • 3-ethyl-1-phenylhept-1-yn-3-ol
    • 1-Heptyn-3-ol,3-ethyl-1-phenyl
    • 3-ethyl-1-phenyl-1-heptyn-3-ol
    • n-Butyl ethyl phenylpropynyl carbinol
    • AKOS024318908
    • FT-0758367
    • DTXSID00606480
    • 19781-33-0
    • SCHEMBL11546576
    • 1-Heptyn-3-ol, 3-ethyl-1-phenyl-
    • MDL： MFCD00041580
    • Inchi： 1S/C15H20O/c1-3-5-12-15(16,4-2)13-11-14-9-7-6-8-10-14/h6-10,16H,3-5,12H2,1-2H3
    • InChI Key： MIVGYFVSMBKLHD-UHFFFAOYSA-N
    • SMILES： OC(C#CC1C=CC=CC=1)(CC)CCCC

Computed Properties

  • Exact Mass: 216.15100
  • Monoisotopic Mass: 216.151415
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 4
  • Complexity: 251
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 4
  • Topological Polar Surface Area: 20.2

Experimental Properties

  • Color/Form: Not determined
  • Density: 0.98
  • Boiling Point: 326.2°Cat760mmHg
  • Flash Point: 144.9°C
  • Refractive Index: 1.532
  • PSA: 20.23000
  • LogP: 3.36940
  • Solubility: Not determined

1-Phenyl-3-ethyl-1-heptyn-3-ol Customs Data

  • HS CODE：2906299090
  • Customs Data：

    China Customs Code:

    2906299090

    Overview:

    2906299090 Other aromatic alcohols. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:5.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2906299090 other aromatic alcohols.Supervision conditions:None.VAT:17.0%.Tax rebate rate:9.0%.MFN tariff:5.5%.General tariff:30.0%

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