6′-Methoxy-3-oxospiro[isobenzofuran-1(3H),9′-[9H]xanthen]-3′-yl 2-fluoro-5-nitrobenzoate

CAS Registry Number®

1609395-29-0
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CAS Name

6′-Methoxy-3-oxospiro[isobenzofuran-1(3H),9′-[9H]xanthen]-3′-yl 2-fluoro-5-nitrobenzoate

Molecular Formula

C28H16FNO8

Molecular Mass

513.43

Cite this Page

6′-Methoxy-3-oxospiro[isobenzofuran-1(3H),9′-[9H]xanthen]-3′-yl 2-fluoro-5-nitrobenzoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1609395-29-0 (retrieved 2024-09-11) (CAS RN: 1609395-29-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    210-211 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C28H16FNO8/c1-35-16-7-9-21-24(13-16)37-25-14-17(36-26(31)19-12-15(30(33)34)6-11-23(19)29)8-10-22(25)28(21)20-5-3-2-4-18(20)27(32)38-28/h2-14H,1H3

InChIKey

InChIKey=DSIXXPVOZGCMEC-UHFFFAOYSA-N

SMILES

O=C1OC2(C=3C(OC=4C2=CC=C(OC)C4)=CC(OC(=O)C5=CC(N(=O)=O)=CC=C5F)=CC3)C=6C1=CC=CC6

Canonical SMILES

O=C(OC1=CC=C2C(OC3=CC(OC)=CC=C3C42OC(=O)C=5C=CC=CC54)=C1)C6=CC(=CC=C6F)N(=O)=O

Other Names for this Substance

  • Benzoic acid, 2-fluoro-5-nitro-, 6′-methoxy-3-oxospiro[isobenzofuran-1(3H),9′-[9H]xanthen]-3′-yl ester
  • 6′-Methoxy-3-oxospiro[isobenzofuran-1(3H),9′-[9H]xanthen]-3′-yl 2-fluoro-5-nitrobenzoate