Fluchloralin

CAS Registry Number®

33245-39-5
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CAS Name

Fluchloralin

Molecular Formula

C12H13ClF3N3O4

Molecular Mass

355.70

Cite this Page

Fluchloralin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=33245-39-5 (retrieved 2024-05-04) (CAS RN: 33245-39-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    42-43 °C

Source(s)

  • (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)

Other Names and Identifiers

InChI

InChI=1S/C12H13ClF3N3O4/c1-2-4-17(5-3-13)11-9(18(20)21)6-8(12(14,15)16)7-10(11)19(22)23/h6-7H,2-5H2,1H3

InChIKey

InChIKey=MNFMIVVPXOGUMX-UHFFFAOYSA-N

SMILES

N(CCC)(CCCl)C1=C(N(=O)=O)C=C(C(F)(F)F)C=C1N(=O)=O

Canonical SMILES

O=N(=O)C=1C=C(C=C(C1N(CCCl)CCC)N(=O)=O)C(F)(F)F

Other Names for this Substance

  • Benzenamine, N-(2-chloroethyl)-2,6-dinitro-N-propyl-4-(trifluoromethyl)-
  • p-Toluidine, N-(2-chloroethyl)-α,α,α-trifluoro-2,6-dinitro-N-propyl-
  • N-(2-Chloroethyl)-2,6-dinitro-N-propyl-4-(trifluoromethyl)benzenamine
  • N-Propyl-N-β-chloroethyl-2,6-dinitro-4-trifluoromethylaniline
  • N-Propyl-N-β-chloroethyl-4-trifluoromethyl-2,6-dinitroaniline

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Deleted or Replaced CAS Registry Numbers

39324-83-9

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