3H-Pyrazol-3-one, 4-(dimethylamino)-1,2-dihydro-1,5-dimethyl-2-phenyl-, compd. with 2,2,3-trichloro-1,1-butanediol (1:1)

CAS Registry Number®

3963-81-3

CAS Name

3H-Pyrazol-3-one, 4-(dimethylamino)-1,2-dihydro-1,5-dimethyl-2-phenyl-, compd. with 2,2,3-trichloro-1,1-butanediol (1:1)

Molecular Formula

C13H17N3O.C4H7Cl3O2

Molecular Mass

424.75

Cite this Page

3H-Pyrazol-3-one, 4-(dimethylamino)-1,2-dihydro-1,5-dimethyl-2-phenyl-, compd. with 2,2,3-trichloro-1,1-butanediol (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=3963-81-3 (retrieved 2025-04-16) (CAS RN: 3963-81-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H17N3O.C4H7Cl3O2/c1-10-12(14(2)3)13(17)16(15(10)4)11-8-6-5-7-9-11;1-2(5)4(6,7)3(8)9/h5-9H,1-4H3;2-3,8-9H,1H3

InChIKey

InChIKey=WJSLIOCJBDDBGK-UHFFFAOYSA-N

SMILES

C(C(C)Cl)(C(O)O)(Cl)Cl.O=C1N(N(C)C(C)=C1N(C)C)C2=CC=CC=C2

Canonical SMILES

O=C1C(=C(N(N1C=2C=CC=CC2)C)C)N(C)C.ClC(C)C(Cl)(Cl)C(O)O

Other Names for this Substance

  • 3H-Pyrazol-3-one, 4-(dimethylamino)-1,2-dihydro-1,5-dimethyl-2-phenyl-, compd. with 2,2,3-trichloro-1,1-butanediol (1:1)
  • Antipyrine, 4-(dimethylamino)-, compd. with 2,2,3-trichloro-1,1-butanediol (1:1)
  • Antipyrine, 4-(dimethylamino)-, compd. with 2,2,3-trichlorobutyraldehyde hydrate (1:1)
  • 1,1-Butanediol, 2,2,3-trichloro-, compd. with 4-(dimethylamino)-1,2-dihydro-1,5-dimethyl-2-phenyl-3H-pyrazol-3-one (1:1)
  • Asciatine

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Deleted or Replaced CAS Registry Numbers

5787-37-1

CAS INSIGHTSTM
Cell Membrane Phospholipid Structure,Phospholipid bilayer of the cell membrane, Lipid bilayer