2-(1-Methylheptyl)-4,6-dinitrophenyl crotonate

CAS Registry Number®

6119-92-2

CAS Name

2-(1-Methylheptyl)-4,6-dinitrophenyl crotonate

Molecular Formula

C18H24N2O6

Molecular Mass

364.39

Cite this Page

2-(1-Methylheptyl)-4,6-dinitrophenyl crotonate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=6119-92-2 (retrieved 2024-11-22) (CAS RN: 6119-92-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C18H24N2O6/c1-4-6-7-8-10-13(3)15-11-14(19(22)23)12-16(20(24)25)18(15)26-17(21)9-5-2/h5,9,11-13H,4,6-8,10H2,1-3H3

InChIKey

InChIKey=NIOPZPCMRQGZCE-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • 2-Butenoic acid, 2-(1-methylheptyl)-4,6-dinitrophenyl ester
  • Crotonic acid, 2-(1-methylheptyl)-4,6-dinitrophenyl ester
  • Phenol, 2-(1-methylheptyl)-4,6-dinitro-, crotonate (ester)
  • 2-(1-Methylheptyl)-4,6-dinitrophenyl crotonate

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