Butralin

CAS Registry Number®

33629-47-9
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CAS Name

Butralin

Molecular Formula

C14H21N3O4

Molecular Mass

295.33

Cite this Page

Butralin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=33629-47-9 (retrieved 2024-04-29) (CAS RN: 33629-47-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    135 °C

  • Melting Point (1)

    60 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C14H21N3O4/c1-6-9(2)15-13-11(16(18)19)7-10(14(3,4)5)8-12(13)17(20)21/h7-9,15H,6H2,1-5H3

InChIKey

InChIKey=SPNQRCTZKIBOAX-UHFFFAOYSA-N

SMILES

N(C(CC)C)C1=C(N(=O)=O)C=C(C(C)(C)C)C=C1N(=O)=O

Canonical SMILES

O=N(=O)C=1C=C(C=C(C1NC(C)CC)N(=O)=O)C(C)(C)C

Other Names for this Substance

  • Benzenamine, 4-(1,1-dimethylethyl)-N-(1-methylpropyl)-2,6-dinitro-
  • Aniline, N-sec-butyl-4-tert-butyl-2,6-dinitro-
  • 4-(1,1-Dimethylethyl)-N-(1-methylpropyl)-2,6-dinitrobenzenamine
  • N-sec-Butyl-4-tert-butyl-2,6-dinitroaniline
  • 70-314B

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Deleted or Replaced CAS Registry Numbers

12676-07-2

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