Cas no 85094-87-7 (2-ethynyl-1-methyl-1H-indole)

2-ethynyl-1-methyl-1H-indole structure
2-ethynyl-1-methyl-1H-indole structure
Product Name:2-ethynyl-1-methyl-1H-indole
CAS No:85094-87-7
MF:C11H9N
MW:155.195862531662
CID:1017374
PubChem ID:12839097
Update Time:2025-04-20

2-ethynyl-1-methyl-1H-indole Chemical and Physical Properties

Names and Identifiers

    • 1H-Indole,2-ethynyl-1-methyl-
    • 1-methyl-2-ethynylindole
    • 2-ethyny-1-methylindole
    • 2-ethynyl-1-methylindole
    • 2-ethynyl-N-methylindole
    • 2-ethynyl-1-methyl-1H-indole
    • EN300-1849718
    • AKOS006240233
    • SCHEMBL14394764
    • 85094-87-7
    • DB-164392
    • Inchi: 1S/C11H9N/c1-3-10-8-9-6-4-5-7-11(9)12(10)2/h1,4-8H,2H3
    • InChI Key: KKFMTTIGOXDYOP-UHFFFAOYSA-N
    • SMILES: N1(C)C(C#C)=CC2C=CC=CC1=2

Computed Properties

  • Exact Mass: 155.07300
  • Monoisotopic Mass: 155.073499291g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 212
  • 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: 2.7
  • Topological Polar Surface Area: 4.9?2

Experimental Properties

  • PSA: 4.93000
  • LogP: 2.15960

2-ethynyl-1-methyl-1H-indole Customs Data

  • HS CODE:2933990090
  • Customs Data:

    China Customs Code:

    2933990090

    Overview:

    2933990090. Other heterocyclic compounds containing only nitrogen heteroatoms. 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, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

2-ethynyl-1-methyl-1H-indole Pricemore >>

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