Methanediol, 1-(3-nitrophenyl)-, 1,1-diacetate

CAS Registry Number®

29949-19-7

CAS Name

Methanediol, 1-(3-nitrophenyl)-, 1,1-diacetate

Molecular Formula

C11H11NO6

Molecular Mass

253.21

Cite this Page

Methanediol, 1-(3-nitrophenyl)-, 1,1-diacetate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=29949-19-7 (retrieved 2025-01-04) (CAS RN: 29949-19-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    72 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C11H11NO6/c1-7(13)17-11(18-8(2)14)9-4-3-5-10(6-9)12(15)16/h3-6,11H,1-2H3

InChIKey

InChIKey=QJNXSPWUBMFCND-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Methanediol, 1-(3-nitrophenyl)-, 1,1-diacetate
  • Toluene-α,α-diol, m-nitro-, diacetate (ester)
  • Methanediol, (3-nitrophenyl)-, diacetate (ester)
  • m-Nitrobenzylidene diacetate
  • 3-Nitrophenylmethanediol diacetate

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