Cas no 1390654-86-0 ((3-chloro-1-benzothien-2-yl)methylamine hydrochloride)

(3-Chloro-1-benzothien-2-yl)methylamine hydrochloride is a heterocyclic organic compound featuring a benzothiophene core substituted with a chloro group at the 3-position and an aminomethyl group at the 2-position, in its hydrochloride salt form. This compound is of interest in medicinal chemistry and pharmaceutical research due to its potential as a building block for bioactive molecules. The hydrochloride salt enhances stability and solubility, facilitating handling and formulation. Its structural motif is valuable in the synthesis of compounds targeting neurological and therapeutic applications. The chloro and amine functional groups provide reactive sites for further derivatization, making it a versatile intermediate in drug discovery and development.
(3-chloro-1-benzothien-2-yl)methylamine hydrochloride structure
1390654-86-0 structure
Product Name:(3-chloro-1-benzothien-2-yl)methylamine hydrochloride
CAS No:1390654-86-0
MF:C9H9Cl2NS
MW:234.145458936691
MDL:MFCD13193900
CID:4596356
Update Time:2025-05-28

(3-chloro-1-benzothien-2-yl)methylamine hydrochloride Chemical and Physical Properties

Names and Identifiers

    • [(3-chloro-1-benzothien-2-yl)methyl]amine hydrochloride
    • (3-chloro-1-benzothien-2-yl)methylamine hydrochloride
    • MDL: MFCD13193900
    • Inchi: 1S/C9H8ClNS.ClH/c10-9-6-3-1-2-4-7(6)12-8(9)5-11;/h1-4H,5,11H2;1H
    • InChI Key: ISQCRQBMNLERKE-UHFFFAOYSA-N
    • SMILES: ClC1=C(SC2=CC=CC=C12)CN.Cl

Computed Properties

  • Exact Mass: 232.983
  • Monoisotopic Mass: 232.983
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 165
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 54.3A^2

(3-chloro-1-benzothien-2-yl)methylamine hydrochloride Security Information

(3-chloro-1-benzothien-2-yl)methylamine hydrochloride Pricemore >>

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