4-(1,1-Dimethylpropyl)-2,6-dinitrophenol

CAS Registry Number®

4097-50-1

CAS Name

4-(1,1-Dimethylpropyl)-2,6-dinitrophenol

Molecular Formula

C11H14N2O5

Molecular Mass

254.24

Cite this Page

4-(1,1-Dimethylpropyl)-2,6-dinitrophenol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=4097-50-1 (retrieved 2024-11-22) (CAS RN: 4097-50-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    66 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C11H14N2O5/c1-4-11(2,3)7-5-8(12(15)16)10(14)9(6-7)13(17)18/h5-6,14H,4H2,1-3H3

InChIKey

InChIKey=BTFCDCNHRPIDHR-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=N(=O)C=1C=C(C=C(C1O)N(=O)=O)C(C)(C)CC

Other Names for this Substance

  • Phenol, 4-(1,1-dimethylpropyl)-2,6-dinitro-
  • Phenol, 2,6-dinitro-4-tert-pentyl-
  • 4-(1,1-Dimethylpropyl)-2,6-dinitrophenol
  • 4-tert-Amyl-2,6-dinitrophenol
  • NSC 21492

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