5-Nitro-1,3-benzenedimethanol

CAS Registry Number®

71176-55-1

CAS Name

5-Nitro-1,3-benzenedimethanol

Molecular Formula

C8H9NO4

Molecular Mass

183.16

Cite this Page

5-Nitro-1,3-benzenedimethanol.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=71176-55-1 (retrieved 2024-11-21) (CAS RN: 71176-55-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    91-92 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H9NO4/c10-4-6-1-7(5-11)3-8(2-6)9(12)13/h1-3,10-11H,4-5H2

InChIKey

InChIKey=FTLFITNFXXERLN-UHFFFAOYSA-N

SMILES

N(=O)(=O)C1=CC(CO)=CC(CO)=C1

Canonical SMILES

O=N(=O)C=1C=C(C=C(C1)CO)CO

Other Names for this Substance

  • 1,3-Benzenedimethanol, 5-nitro-
  • 5-Nitro-1,3-benzenedimethanol
  • 3-(Hydroxymethyl)-5-nitrobenzyl alcohol
  • 5-Nitro-1,3-di(hydroxymethyl)benzene
  • 3,5-Bis-(hydroxymethyl)nitroxylylene

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration