Benzoic acid, 4-(phenylmethoxy)-3-(sulfooxy)-, 1-methyl ester, sodium salt (1:1)

CAS Registry Number®

1391054-55-9
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CAS Name

Benzoic acid, 4-(phenylmethoxy)-3-(sulfooxy)-, 1-methyl ester, sodium salt (1:1)

Molecular Formula

C15H14O7S.Na

Cite this Page

Benzoic acid, 4-(phenylmethoxy)-3-(sulfooxy)-, 1-methyl ester, sodium salt (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1391054-55-9 (retrieved 2024-08-28) (CAS RN: 1391054-55-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C15H14O7S.Na/c1-20-15(16)12-7-8-13(14(9-12)22-23(17,18)19)21-10-11-5-3-2-4-6-11;/h2-9H,10H2,1H3,(H,17,18,19);

InChIKey

InChIKey=OVTBEKWBHLFLEB-UHFFFAOYSA-N

SMILES

O(S(=O)(=O)O)C1=C(OCC2=CC=CC=C2)C=CC(C(OC)=O)=C1.[Na]

Canonical SMILES

[Na].O=C(OC)C1=CC=C(OCC=2C=CC=CC2)C(OS(=O)(=O)O)=C1

Other Names for this Substance

  • Benzoic acid, 4-(phenylmethoxy)-3-(sulfooxy)-, 1-methyl ester, sodium salt (1:1)