Cas no 131004-28-9 (4-Thiazoleacetic acid, a-(methoxyimino)-2-[(triphenylmethyl)amino]-,hydrochloride (1:1), (aZ)-)

4-Thiazoleacetic acid, a-(methoxyimino)-2-[(triphenylmethyl)amino]-,hydrochloride (1:1), (aZ)- structure
131004-28-9 structure
Product Name:4-Thiazoleacetic acid, a-(methoxyimino)-2-[(triphenylmethyl)amino]-,hydrochloride (1:1), (aZ)-
CAS No:131004-28-9
MF:C25H22ClN3O3S
MW:479.97848367691
CID:102450
PubChem ID:9566066
Update Time:2025-04-18

4-Thiazoleacetic acid, a-(methoxyimino)-2-[(triphenylmethyl)amino]-,hydrochloride (1:1), (aZ)- Chemical and Physical Properties

Names and Identifiers

    • 4-Thiazoleacetic acid, a-(methoxyimino)-2-[(triphenylmethyl)amino]-,hydrochloride (1:1), (aZ)-
    • (Z)(METHOXYIMINO)[2(TRITYLAMINO)THIAZOL- 4-YL]ACET.AC.MONOHCL
    • (Z)-(Methoxyimino)[2-(tritylamino)thiazol-4-yl]acetic acid monohydrochloride
    • (Z)-[2-(Tritylamino)thiazol-4-yl](methoxyimino)acetic acid monohydrochloride
    • (Z)-[2-(Tritylamino)thiazol-4-yl](methoxyimino)acetic acid monohydrochloride
    • (2Z)-2-Methoxyimino-2-[2-(tritylamino)-1,3-thiazol-4-yl]acetic acid;hydrochloride
    • AKOS005256943
    • 123333-74-4
    • (Z)(Methoxyimino)[2(tritylamino)thiazol-4-yl]acet.ac.monohcl
    • 131004-28-9
    • SCHEMBL5096542
    • (E)-2-(methoxyimino)-2-(2-(tritylamino)thiazol-4-yl)acetic acid hydrochloride
    • (Z)-2-(Methoxyimino)-2-(2-(tritylamino)thiazol-4-yl)acetic acid hydrochloride
    • 2-(Tritylamino)-alpha-(methoxyimino)-4-thiazoleacetic acid hydrochloride
    • SCHEMBL7776981
    • 4-Thiazoleacetic acid,a-(methoxyimino)-2-[(triphenylmethyl)amino]-,hydrochloride(1:1)
    • Inchi： 1S/C25H21N3O3S.ClH/c1-31-28-22(23(29)30)21-17-32-24(26-21)27-25(18-11-5-2-6-12-18,19-13-7-3-8-14-19)20-15-9-4-10-16-20;/h2-17H,1H3,(H,26,27)(H,29,30);1H/b28-22-;
    • InChI Key： WUGYSHABNSMIRY-BKHQUBCMSA-N
    • SMILES： Cl.S1C=C(/C(/C(=O)O)=N/OC)N=C1NC(C1C=CC=CC=1)(C1C=CC=CC=1)C1C=CC=CC=1

Computed Properties

  • Exact Mass: 479.10700
  • Monoisotopic Mass: 479.1070404g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 7
  • Heavy Atom Count: 33
  • Rotatable Bond Count: 8
  • Complexity: 595
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 112?2

Experimental Properties

  • PSA: 112.05000
  • LogP: 5.85720

4-Thiazoleacetic acid, a-(methoxyimino)-2-[(triphenylmethyl)amino]-,hydrochloride (1:1), (aZ)- Related Literature

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