Binapacryl

CAS Registry Number®

485-31-4

CAS Name

Binapacryl

Molecular Formula

C15H18N2O6

Molecular Mass

322.31

Cite this Page

Binapacryl.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=485-31-4 (retrieved 2024-11-24) (CAS RN: 485-31-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    66-67 °C

  • Density (1)

    1.2307 g/cm³ @ Temp: 20 °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/C15H18N2O6/c1-5-10(4)12-7-11(16(19)20)8-13(17(21)22)15(12)23-14(18)6-9(2)3/h6-8,10H,5H2,1-4H3

InChIKey

InChIKey=ZRDUSMYWDRPZRM-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(OC=1C(=CC(=CC1C(C)CC)N(=O)=O)N(=O)=O)C=C(C)C

Other Names for this Substance

  • 2-Butenoic acid, 3-methyl-, 2-(1-methylpropyl)-4,6-dinitrophenyl ester
  • Crotonic acid, 3-methyl-, 2-sec-butyl-4,6-dinitrophenyl ester
  • HOE 2784
  • NIA 9044
  • Acricid

View All

Deleted or Replaced CAS Registry Numbers

1135443-30-9

CAS INSIGHTSTM
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