CAS Registry Number®

1173097-77-2

Molecular Formula

C15H5Cl2D8N5.ClH

Cite this Page

.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1173097-77-2 (retrieved 2024-11-25) (CAS RN: 1173097-77-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C15H13Cl2N5.ClH/c16-13-5-1-11(2-6-13)9-19-21-15(18)22-20-10-12-3-7-14(17)8-4-12;/h1-10H,(H3,18,21,22);1H/i1D,2D,3D,4D,5D,6D,7D,8D;

InChIKey

InChIKey=LTWIBTYLSRDGHP-AGHVBCBTSA-N

SMILES

C(=NNC(NN=CC1=C(C(=C(Cl)C(=C1[2H])[2H])[2H])[2H])=N)C2=C(C(=C(Cl)C(=C2[2H])[2H])[2H])[2H].Cl

Canonical SMILES

Cl.ClC1=CC=C(C=NNC(=N)NN=CC2=CC=C(Cl)C=C2)C=C1

Other Names for this Substance

  • 1,3-Bis[(4-chloro-2,3,5,6-tetradeuteriophenyl)methylideneamino]guanidine hydrochloride

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