Cas no 840537-99-7 (4-(Benzyloxy)-6-methyl-1H-indole)

4-(Benzyloxy)-6-methyl-1H-indole structure
840537-99-7 structure
Product Name:4-(Benzyloxy)-6-methyl-1H-indole
CAS No:840537-99-7
MF:C16H15NO
MW:237.296404123306
MDL:MFCD08690117
CID:716240
PubChem ID:21904252
Update Time:2025-04-19

4-(Benzyloxy)-6-methyl-1H-indole Chemical and Physical Properties

Names and Identifiers

    • 4-(Benzyloxy)-6-methyl-1H-indole
    • 1H-Indole,6-methyl-4-(phenylmethoxy)-
    • 4-Benzyloxy-6-methyl indole
    • 6-methyl-4-phenylmethoxy-1H-indole
    • 1H-Indole,6-methyl-4-(phenylmethoxy)
    • AKOS022171971
    • 840537-99-7
    • DTXSID50619808
    • SCHEMBL3044287
    • CS-0456125
    • DS-6789
    • Ethyl 2-((3-methyl-1-nitrobutan-2-yl)thio)acetate
    • FT-0768254
    • DB-075994
    • MDL: MFCD08690117
    • Inchi: 1S/C16H15NO/c1-12-9-15-14(7-8-17-15)16(10-12)18-11-13-5-3-2-4-6-13/h2-10,17H,11H2,1H3
    • InChI Key: MSBBKVWWPURXKR-UHFFFAOYSA-N
    • SMILES: O(CC1C=CC=CC=1)C1=CC(C)=CC2=C1C=CN2

Computed Properties

  • Exact Mass: 237.11500
  • Monoisotopic Mass: 237.115364102g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 3
  • Complexity: 262
  • 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: 3.9
  • Topological Polar Surface Area: 25?2

Experimental Properties

  • Boiling Point: 420.9±30.0℃ at 760 mmHg
  • PSA: 25.02000
  • LogP: 4.05530

4-(Benzyloxy)-6-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%

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