Cas no 1090-53-5 (1,2-Benzisoxazole-3-carboxylicacid, 4,5,6,7-tetrahydro-, 2-(phenylmethyl)hydrazide, hydrochloride (1:1))

1,2-Benzisoxazole-3-carboxylicacid, 4,5,6,7-tetrahydro-, 2-(phenylmethyl)hydrazide, hydrochloride (1:1) structure
1090-53-5 structure
Product Name:1,2-Benzisoxazole-3-carboxylicacid, 4,5,6,7-tetrahydro-, 2-(phenylmethyl)hydrazide, hydrochloride (1:1)
CAS No:1090-53-5
MF:C15H18ClN3O2
MW:307.775322437286
CID:166261
PubChem ID:121007
Update Time:2025-04-19

1,2-Benzisoxazole-3-carboxylicacid, 4,5,6,7-tetrahydro-, 2-(phenylmethyl)hydrazide, hydrochloride (1:1) Chemical and Physical Properties

Names and Identifiers

    • 1,2-Benzisoxazole-3-carboxylicacid, 4,5,6,7-tetrahydro-, 2-(phenylmethyl)hydrazide, hydrochloride (1:1)
    • 1,2-Benzisoxazole-3-carboxylic acid, 4,5,6,7-tetrahydro-, 2-benzylhydrazide,monohydrochloride (8CI)
    • 1,2-Benzisoxazole-3-carboxylicacid, 4,5,6,7-tetrahydro-, 2-(phenylmethyl)hydrazide, monohydrochloride (9CI)
    • 1-Benzyl-2-(4,5,6,7-tetrahydro-1,2-benzisoxazol-3-yl)carbonylhydrazinehydrochloride
    • N'-Benzyl-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carbohydrazide--hydrogen chloride (1/1)
    • DTXSID20910955
    • 1-Benzyl-2-(3-(4,5,6,7-tetrahydrobenzisoxazolyl)carbonyl)hydrazine hydrochloride
    • 1090-53-5
    • Hydrazine, 1-benzyl-2-(3-(4,5,6,7-tetrahydrobenzisoxazolyl)carbonyl)-, hydrochloride
    • Inchi： 1S/C15H17N3O2.ClH/c19-15(17-16-10-11-6-2-1-3-7-11)14-12-8-4-5-9-13(12)20-18-14;/h1-3,6-7,16H,4-5,8-10H2,(H,17,19);1H
    • InChI Key： BNWAOBSVICDNKQ-UHFFFAOYSA-N
    • SMILES： Cl.O1C2=C(C(C(NNCC3C=CC=CC=3)=O)=N1)CCCC2

Computed Properties

  • Exact Mass: 307.10894
  • Monoisotopic Mass: 307.108755
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 4
  • Complexity: 331
  • 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: 67.2

Experimental Properties

  • Boiling Point: 470.6°C at 760 mmHg
  • Flash Point: 238.4°C
  • PSA: 67.16

1,2-Benzisoxazole-3-carboxylicacid, 4,5,6,7-tetrahydro-, 2-(phenylmethyl)hydrazide, hydrochloride (1:1) Security Information

  • Safety Term：x and HCl."> Poison by ingestion. Moderately toxic by intraperitoneal route. When heated to decomposition it emits toxic fumes of NOx and HCl.

1,2-Benzisoxazole-3-carboxylicacid, 4,5,6,7-tetrahydro-, 2-(phenylmethyl)hydrazide, hydrochloride (1:1) Related Literature

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