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56047-23-5

Basic Information
CAS No.: 56047-23-5
Name: 4-CHLOROPHTHALIC ACID MONOSODIUM SALT
Article Data: 1
Molecular Structure:
Molecular Structure of 56047-23-5 (4-CHLOROPHTHALIC ACID MONOSODIUM SALT)
Formula: C8H5 Cl O4 . Na
Molecular Weight: 222.56
Synonyms: 1,2-Benzenedicarboxylicacid, 4-chloro-, monosodium salt (9CI); Phthalic acid, 4-chloro-, sodium salt(6CI); 4-Chloro-o-phthalic acid sodium salt; 4-Chlorophthalic acid monosodiumsalt; Monosodium 4-chlorophthalate
EINECS: 259-963-2
Density: g/cm3
Boiling Point: 399.5 °C at 760 mmHg
Flash Point: 195.4 °C
Solubility: Soluble in water
Appearance: white to light tan powder.
Hazard Symbols: HarmfulXn
Risk Codes: 20/21/22-36
Safety: 26-36
Transport Information: UN 2811 6
PSA: 77.43000
LogP: 0.40170
Synthetic route
85-44-9

phthalic anhydride

56047-23-5

monosodique de l'acide chloro-4 phtalique

Conditions
ConditionsYield
Stage #1: phthalic anhydride With sodium chlorate; sodium hydroxide In water at 28 - 30℃; for 17h;
Stage #2: With hydrogenchloride In water at 30℃; pH=Ca. 5.5;
56047-23-5

monosodique de l'acide chloro-4 phtalique

118-45-6

4-chlorophthalic anhydride

Conditions
ConditionsYield
With thionyl chloride for 2h; Heating;70%
With sulfuric acid In acetic anhydride for 3h; Heating;
With thionyl chloride for 2h; Reflux;
64-17-5

ethanol

56047-23-5

monosodique de l'acide chloro-4 phtalique

38717-95-2

4-chlorodiethylphthalate

Conditions
ConditionsYield
With hydrogenchloride at 80℃; for 48h; Esterification;62%
56047-23-5

monosodique de l'acide chloro-4 phtalique

173962-58-8

4-chloro-2-hydroxy-1(H)-isoindole-1,3-dione

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: 62 percent / HCl(g) / 48 h / 80 °C
2: hydroxylamine; KOH / methanol / 8 h / -70 °C / RT, 72 h
View Scheme
56047-23-5

monosodique de l'acide chloro-4 phtalique

4-chloro-2-methylsulfonyloxy-1(H)-isoindole-1,3-dione

Conditions
ConditionsYield
Multi-step reaction with 3 steps
1: 62 percent / HCl(g) / 48 h / 80 °C
2: hydroxylamine; KOH / methanol / 8 h / -70 °C / RT, 72 h
3: 48 percent / NaHCO3 / H2O / 3 h / 0 °C
View Scheme
56047-23-5

monosodique de l'acide chloro-4 phtalique

4-chloro-2-isopropylsulfonyloxy-1(H)-isoindole-1,3-dione

Conditions
ConditionsYield
Multi-step reaction with 3 steps
1: 62 percent / HCl(g) / 48 h / 80 °C
2: hydroxylamine; KOH / methanol / 8 h / -70 °C / RT, 72 h
3: 56 percent / NaHCO3 / H2O / 3 h / 0 °C
View Scheme
56047-23-5

monosodique de l'acide chloro-4 phtalique

7147-90-2

4-chlorophthalimide

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: 70 percent / thionylchloride / 2 h / Heating
2: 98 percent / urea / 0.67 h / Heating
View Scheme
Multi-step reaction with 2 steps
1: thionyl chloride / 2 h / Reflux
2: formamide / 1 h / 150 °C
View Scheme
56047-23-5

monosodique de l'acide chloro-4 phtalique

19641-29-3

6-chlorophthalide

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: H2SO4 / acetic anhydride / 3 h / Heating
2: 83 percent / NaBH4 / methanol
View Scheme
56047-23-5

monosodique de l'acide chloro-4 phtalique

22018-96-8

5-chloro-1H-indene-1,3(2H)-dione

Conditions
ConditionsYield
Multi-step reaction with 4 steps
1: H2SO4 / acetic anhydride / 3 h / Heating
2: 2 h / Heating
3: 1.) SOCl2 / 1.) reflux; 2.) benzene, reflux, 1.5 h
4: Na / reflux 2 h, then r.t., 15 h
View Scheme
56047-23-5

monosodique de l'acide chloro-4 phtalique

chloro-4 phtalate acide d'ethyle

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: H2SO4 / acetic anhydride / 3 h / Heating
2: 2 h / Heating
View Scheme
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Chemistry


IUPAC Name: Sodium 2-carboxy-5-chlorobenzoate 
Empirical Formula: C8H3ClNaO4
Molecular Weight: 221.5503 
Nominal Mass: 221 
Average Mass: 221.5503 
Monoisotopic Mass: 220.962305
Canonical SMILES: C1=CC(=C(C=C1Cl)C(=O)[O-])C(=O)O.[Na+]
InChI: InChI=1S/C8H5ClO4.Na/c9-4-1-2-5(7(10)11)6(3-4)8(12)13;/h1-3H,(H,10,11)(H,12,13);/q;+1/p-1
InChIKey: MWZMHSGEQHVWED-UHFFFAOYSA-M
EINECS: 259-963-2 
H-Bond Donor: 1
H-Bond Acceptor: 4 
Freely Rotating Bonds of 4-Chlorophthalic acid monosodium salt (CAS NO.56047-23-5): 2

Safety Profile

Hazard Codes: HarmfulXn
Risk Statements: 20/21/22-36 
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed. 
R36:Irritating to eyes.
Safety Statements: 26-36 
S26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. 
S36:Wear suitable protective clothing.
RIDADR: UN 2811 6.1/PG 3
WGK Germany: 3
HazardClass: 6.1(b)
PackingGroup of 4-Chlorophthalic acid monosodium salt (CAS NO.56047-23-5): III

Specification

  4-Chlorophthalic acid monosodium salt (CAS NO.56047-23-5), its Synonyms are 1,2-Benzenedicarboxylic acid, 4-chloro-, monosodium salt ; 1,2-Benzenedicarboxylic acid, 4-chloro-, sodium salt (1:1) ; Monosodium hydrogen 4-chlorophthalate ; Sodium 4-chlorophthalate . It is white to tan to beige crystalline powder.