Cas no 200631-40-9 (3,3-Dimethyl-2-tosyl-1,2,3,4-tetrahydroisoquinoline)

3,3-Dimethyl-2-tosyl-1,2,3,4-tetrahydroisoquinoline structure
200631-40-9 structure
Product Name:3,3-Dimethyl-2-tosyl-1,2,3,4-tetrahydroisoquinoline
CAS No:200631-40-9
MF:C18H21NO2S
MW:315.429843664169
CID:1089116
PubChem ID:10852836
Update Time:2025-09-24

3,3-Dimethyl-2-tosyl-1,2,3,4-tetrahydroisoquinoline Chemical and Physical Properties

Names and Identifiers

    • 3,3-Dimethyl-2-tosyl-1,2,3,4-tetrahydroisoquinoline
    • 3,3-dimethyl-2-(4-methylphenyl)sulfonyl-1,4-dihydroisoquinoline
    • DTXSID40445875
    • 200631-40-9
    • Isoquinoline, 1,2,3,4-tetrahydro-3,3-dimethyl-2-[(4-methylphenyl)sulfonyl]-
    • AGN-PC-0NBNWV
    • SCHEMBL6826623
    • Inchi: 1S/C18H21NO2S/c1-14-8-10-17(11-9-14)22(20,21)19-13-16-7-5-4-6-15(16)12-18(19,2)3/h4-11H,12-13H2,1-3H3
    • InChI Key: ZKYIZSVUFRFZGY-UHFFFAOYSA-N
    • SMILES: S(C1C=CC(C)=CC=1)(N1CC2C=CC=CC=2CC1(C)C)(=O)=O

Computed Properties

  • Exact Mass: 315.12930009g/mol
  • Monoisotopic Mass: 315.12930009g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 2
  • Complexity: 486
  • 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: 3.6
  • Topological Polar Surface Area: 45.8?2

3,3-Dimethyl-2-tosyl-1,2,3,4-tetrahydroisoquinoline Pricemore >>

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