Benzenemethanol, 3-nitro-, 1-acetate

CAS Registry Number®

21388-97-6

CAS Name

Benzenemethanol, 3-nitro-, 1-acetate

Molecular Formula

C9H9NO4

Molecular Mass

195.17

Cite this Page

Benzenemethanol, 3-nitro-, 1-acetate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=21388-97-6 (retrieved 2024-12-04) (CAS RN: 21388-97-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    161-163 °C @ Press: 20 Torr
  • Melting Point (1)

    36 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H9NO4/c1-7(11)14-6-8-3-2-4-9(5-8)10(12)13/h2-5H,6H2,1H3

InChIKey

InChIKey=WNVPZUAAKWXDNS-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(OCC=1C=CC=C(C1)N(=O)=O)C

Other Names for this Substance

  • Benzenemethanol, 3-nitro-, 1-acetate
  • Benzyl alcohol, m-nitro-, acetate (ester)
  • Benzenemethanol, 3-nitro-, acetate (ester)
  • m-Nitrobenzyl acetate
  • 3-Nitrobenzyl acetate

CAS INSIGHTSTM
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