5-Sulfoisophthalic acid monolithium salt

Inquiry

Molecular Formula:

C8H5LiO7S

Molecular Weight:

252.13

CAS Number:

46728-75-0

Catalog Number:

46728-75-0

Product Information

Molecular Formula:

C8H5LiO7S

Molecular Weight:

252.13

Description

Monomer for water-dispersible polyesters.

Synonyms

1,3-Benzenedicarboxylicacid,5-sulfo-,monolithiumsalt; 3-benzenedicarboxylicacid,5-sulfo-monolithiumsalt; 5-Sulfoisophthalatemonolithiumsalt; LISIP; LI-SIPA; LITHIUM 5-SULFO-1,3-BENZENEDICARBOXYLATE; LITHIOSULFO ISOPHTHALIC ACID; 5-SULFOBENZENE-1,3-DICARBOXYLIC

IUPAC Name

lithium3-carboxy-5-sulfobenzoate

Canonical SMILES

[Li+].C1=C(C=C(C=C1C(=O)[O-])S(=O)(=O)O)C(=O)O

InChI

InChI=1S/C8H6O7S.Li/c9-7(10)4-1-5(8(11)12)3-6(2-4)16(13,14)15/h1-3H,(H,9,10)(H,11,12)(H,13,14,15)/q+1/p-1

InChI Key

GGKPBCOOXDBLLG-UHFFFAOYSA-M

Melting Point

>300 °C (lit.)

Safety Information

Hazards

H318

Precautionary Statement

P280 - P305 + P351 + P338

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

251.99160210 g/mol

Monoisotopic Mass

251.99160210 g/mol

Topological Polar Surface Area

140Å²

Heavy Atom Count

Formal Charge

Complexity

399

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

Compound Is Canonicalized

Yes

The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

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The dilution calculator equation

Concentration _(start) × Volume _(start) = Concentration _(final) × Volume _(final)

This equation is commonly abbreviated as: C₁V₁ = C₂V₂

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5-Sulfoisophthalic acid monolithium salt

Product Information

Safety Information

Computed Properties

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