Cas no 35859-48-4 (2-(morpholin-4-yl)ethyl [(4-chlorophenyl)sulfanyl]acetate hydrochloride (1:1))

2-(morpholin-4-yl)ethyl [(4-chlorophenyl)sulfanyl]acetate hydrochloride (1:1) structure
35859-48-4 structure
Product Name:2-(morpholin-4-yl)ethyl [(4-chlorophenyl)sulfanyl]acetate hydrochloride (1:1)
CAS No:35859-48-4
MF:C14H19Cl2NO3S
MW:352.276561021805
CID:1473846
PubChem ID:215592
Update Time:2025-04-20

2-(morpholin-4-yl)ethyl [(4-chlorophenyl)sulfanyl]acetate hydrochloride (1:1) Chemical and Physical Properties

Names and Identifiers

    • 2-(morpholin-4-yl)ethyl [(4-chlorophenyl)sulfanyl]acetate hydrochloride (1:1)
    • 2-(Morpholin-4-yl)ethyl [(4-chlorophenyl)sulfanyl]acetate--hydrogen chloride (1/1)
    • 35859-48-4
    • Acetic acid, ((4-chlorophenyl)thio)-, 2-(4-morpholinyl)ethyl ester, hydrochloride
    • 2-(4-Morpholinyl)ethyl ((4-chlorophenyl)thio)acetate hydrochloride
    • DTXSID80957280
    • Inchi: 1S/C14H18ClNO3S.ClH/c15-12-1-3-13(4-2-12)20-11-14(17)19-10-7-16-5-8-18-9-6-16;/h1-4H,5-11H2;1H
    • InChI Key: QTWMBXVLFPLQDM-UHFFFAOYSA-N
    • SMILES: ClC1C=CC(=CC=1)SCC(=O)OCCN1CCOCC1.Cl

Computed Properties

  • Exact Mass: 351.04647
  • Monoisotopic Mass: 351.0462700g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 7
  • Complexity: 292
  • 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: 64.1?2

Experimental Properties

  • PSA: 38.77
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