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827-27-0

Basic Information
CAS No.: 827-27-0
Name: PHTHALIC ACID DISODIUM SALT
Article Data: 8
Molecular Structure:
Molecular Structure of 827-27-0 (PHTHALIC ACID DISODIUM SALT)
Formula: C8H4NaO4
Molecular Weight: 188.115
Synonyms: Phthalic acid, monosodium salt (8CI);Monosodiumphthalate;1,2-Benzenedicarboxylicacid, monosodium salt (9CI);Sodium acid phthalate;Sodium hemiphthalate;Sodium hydrogenphthalate;1,2-Benzenedicarboxylic acid, sodium salt (1:1);
EINECS: 212-568-9
Melting Point: 230oC
PSA: 77.43000
LogP: -0.25170
Synthetic route
88-99-3

benzene-1,2-dicarboxylic acid

827-27-0

sodium hydrogen phthalate hemihydrate

Conditions
ConditionsYield
With sodium hydrogencarbonate In water
827-27-0

sodium hydrogen phthalate hemihydrate

105-39-5

chloroacetic acid ethyl ester

1830-13-3

phthaloyldioxydi-acetic acid diethyl ester

1600-27-7

mercury(II) diacetate

827-27-0

sodium hydrogen phthalate hemihydrate

64-19-7

acetic acid

A

124-38-9

carbon dioxide

B

o-hydroxomercurio-benzoic acid-anhydride

o-hydroxomercurio-benzoic acid-anhydride

1202-34-2

di(pyridin-2-yl)amine

827-27-0

sodium hydrogen phthalate hemihydrate

nickel(II) nitrate

triaqua{1,2-benzenedicarboxylato(2-)}(2,2'-dipyridylamine)nickel(II) dihydrate

Conditions
ConditionsYield
With H2O In water slow evapn. from dilute aq. soln. contg. equimolar amts. of nitrate, diamine and sodium phthalate;
66-71-7

1,10-Phenanthroline

827-27-0

sodium hydrogen phthalate hemihydrate

cobalt(II) nitrate

{Co(C8H4O4)(C12H8N2)(H2O)3}*H2O

Conditions
ConditionsYield
With H2O In water slow evapn. from dilute aq. soln. contg. equimolar amts. of nitrate, diamine and sodium phthalate;
66-71-7

1,10-Phenanthroline

827-27-0

sodium hydrogen phthalate hemihydrate

nickel(II) nitrate

triaqua{1,2-benzenedicarboxylato(2-)}(1,10-phenanthroline)nickel(II)monohydrate

Conditions
ConditionsYield
With H2O In water slow evapn. from dilute aq. soln. contg. equimolar amts. of nitrate, diamine and sodium phthalate;

copper(ll) sulfate pentahydrate

ammonium molybdate

827-27-0

sodium hydrogen phthalate hemihydrate

14285-62-2

[29H,31H-phthalocyanine-2,9,16,23-tetrasulfonato(2-)-N29,N30,N31,N32]copper

Conditions
ConditionsYield
With NH4Cl; urea In nitrobenzene mixture ground until homogenous, added slowly to nitrobenzene while temp. maintained between 160 and 190°C, heated for further 6 h at 180°C; ground, washed with MeOH, placed in HCl satd. with NaCl, dialysed through a cellulose membrane for 6 days, filtered, concd., refluxed with EtOHfor 2 h, filtered, vacuum dried (E-3 mmHg) at room temp., UV, elem. anal.;

copper(II) choride dihydrate

827-27-0

sodium hydrogen phthalate hemihydrate

Conditions
ConditionsYield
In water hot soln. of Na salt (distd. H2O) poured to soln. of Cu salt in min. amt. of hot distd. H2O in stoich. ratio; cooled to room temp., ppt. filtered, washed (H2O), dried in air; elem. anal., detd. by TGA;

cobalt(II) nitrate hexahydrate

827-27-0

sodium hydrogen phthalate hemihydrate

[cobalt(II)hexahydrate]biphthalate

Conditions
ConditionsYield
In water hot soln. of Na salt (distd. H2O) poured to soln. of Co salt in min. amt. of hot distd. H2O in stoich. ratio; cooled to room temp., ppt. filtered, washed (H2O), dried in air; elem. anal., detd. by TGA;

ferrous(II) sulfate heptahydrate

827-27-0

sodium hydrogen phthalate hemihydrate

[iron(II)hexahydrate]biphthalate

Conditions
ConditionsYield
In water in inert atm.; hot soln. of Na salt (distd. H2O) poured to soln. of Fe salt in min. amt. of hot distd. H2O in stoich. ratio; cooled to room temp., ppt. filtered, washed (H2O), dried in air, recrystd. from H2O; elem. anal., detd. by TGA;
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Specification

The 1,2-Benzenedicarboxylicacid, sodium salt (1:1), with the CAS registry number 827-27-0 and EINECS registry number 212-568-9, is also called 1,2-Benzenedicarboxylic acid, monosodium salt. The molecular formula of this chemical is C8H4NaO4.

The physical properties of 1,2-Benzenedicarboxylicacid, sodium salt (1:1) are as followings: (1)#H bond acceptors: 4; (2)#H bond donors: 2; (3)#Freely Rotating Bonds: 2; (4)Polar Surface Area: 80.26 Å2.

You can still convert the following datas into molecular structure:
(1)SMILES: [Na+].O=C([O-])c1ccccc1C([O-])=O
(2)InChI: InChI=1/C8H6O4.Na/c9-7(10)5-3-1-2-4-6(5)8(11)12;/h1-4H,(H,9,10)(H,11,12);/q;+1/p-2
(3)InChIKey: IZUPJOYPPLEPGM-NUQVWONBAE