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Natriumdihydrogencitrat

Monosodium Citrate

HCID 23666341
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Grundinformationen

CAS
18996-35-5
Standard-SMILES
O=C([O-])CC(O)(CC(=O)O)C(=O)O.[Na+]
InChIKey
HWPKGOGLCKPRLZ-UHFFFAOYSA-M
Summenformel
C6H7NaO7
Durchschnittliche Molmasse
214,1 g/mol
Monoisotopische Masse
214,00894684

Namen und Bezeichner

Bevorzugter Name
Monosodium Citrate
IUPAC
sodium 3-carboxy-3,5-dihydroxy-5-oxopentanoate
Lokaler Name
Natriumdihydrogencitrat
Englischer Name
Sodium dihydrogen citrate
Summenformel
C6H9NaO7
Molmasse
216.12

Namen und Synonyme

18996-35-5Monosodium citrateSodium citrate monobasicSodium dihydrogen citrate1,2,3-Propanetricarboxylic acid, 2-hydroxy-, monosodium salt1,2,3-Propanetricarboxylic acid, 2-hydroxy-, sodium salt (1:1)DTXSID8087290468538UP9SEE 331IRefChem:159615DTXCID707348242-734-6
Weitere Namen anzeigen
DIHYDROGEN CITRATEcitrofluylcitricacid,sodiumsaltNatriumdihydrogencitratmonosodiumdihydrogencitrate
sodium 3,4-dicarboxy-3-hydroxybutanoateCitric acid monosodium saltC6H7NaO7Monosodium Citrate Anhydroussodium;3-carboxy-3,5-dihydroxy-5-oxopentanoateSodium dihydrogencitratemono sodium citrateMFCD00013067

Datenbank-Bezeichner

CAS
18996-35-5
PubChem CID
23666341
DTXSID
DTXSID80872904
EC Number
242-734-6
Nikkaji
J1.390.397B

Eigenschaften

Berechnete Struktureigenschaften

Polarare Oberfläche (TPSA)
135 Ų
H-Brücken-Donoren
3
H-Brücken-Akzeptoren
7
Frei drehbare Bindungen
5
Schwere Atome
14
Formalladung
0
Komplexität
251

Experimentelle und physikochemische Eigenschaften

Chemical ClassesMetals -> Organic Acids, Metal Salts
CosmeticsCosmetic ingredients (Monosodium Citrate) -> CIR (Cosmetic Ingredient Review)
pHBetween 3,5 and 3,8 (1 % aqueous solution)
Food Contact SubstancesFCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR
Physical Description · 3 Einträge

Liquid; Liquid; Other Solid; Dry Powder

Crystalline white powder or colourless crystals

White odorless solid; [JECFA] White crystalline powder; [Alfa Aesar MSDS]

Physikochemische Eigenschaften

Schmelzpunkt
212 °C · 212 °C(lit.)
storage temp.
Inert atmosphere,Room Temperature
Löslichkeit
2 O: · H2O: 0.25 M at 20 °C, clear, colorless
Aggregatzustand
Crystalline Powder
Farbe
White

Sicherheit und Regulatorisches

Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.

GHS-Klassifizierung

GHS Classification · 3 Einträge

This chemical does not meet GHS hazard criteria for 98.7% (226 of 229) of all reports.

Not Classified

Aggregated GHS information provided per 229 reports by companies from 4 notifications to the ECHA C&L Inventory.

Gefahrenhinweise

Regulatory Information · 4 Einträge

Chemical: 1,2,3-Propanetricarboxylic acid, 2-hydroxy-, monosodium salt

1,2,3-Propanetricarboxylic acid, 2-hydroxy-, sodium salt (1:1) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1,2,3-Propanetricarboxylic acid, 2-hydroxy-, sodium salt (1:1) are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)

Status: Active Update: 31-05-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/14189

Monosodium citrate: Does not have an individual approval but may be used under an appropriate group standard

Other Safety InformationIMAP assessments - 1,2,3-Propanetricarboxylic acid, 2-hydroxy-, monosodium salt: Human health tier I assessment
Hazards SummaryCauses convulsions in intraperitoneal lethal-dose studies of mice and rats; [RTECS] Acceptable daily intake (ADI) as food additive not limited; [JECFA] May cause irritation; [Alfa Aesar MSDS] See Citric acid.
EPA Safer ChemicalChemical: Sodium dihydrogen citrate
Hazard Classes and CategoriesNot Classified

Sicherheit und Schutzausrüstung

Chemie und Industrie

Pharmakologische Informationen

MeSH Pharmacological Classification · 3 Einträge

Agents that prevent BLOOD CLOTTING.

A chemical system that functions to control the levels of specific ions in solution. When the level of hydrogen ion in solution is controlled the system is called a pH buffer.

Substances capable of inhibiting, retarding or arresting the process of fermentation, acidification or other deterioration of foods.

Verwendung und Herstellung

Uses · 2 Einträge

CIR ingredient: Monosodium Citrate

Used as a buffering agent and sequestrant for food; [JECFA] Permitted for use as an inert ingredient in non-food pesticide products; [EPA]

U.S. Production2023: 850,000 - <1,000,000 lb
Consumer UsesPropellants, non-motive (blowing agents)
Industry UsesPropellants, non-motive (blowing agents)
Household ProductsInformation on 47 consumer products that contain Sodium dihydrogen citrate in the following categories is provided:
Use Classification · 6 Einträge

EPA Safer Chemical Functional Use Classes -> Processing Aids and Additives

Safer Chemical Classes -> Green circle - The chemical has been verified to be of low concern

Food additives

Food Additives -> ACIDITY_REGULATOR; SEQUESTRANT -> JECFA Functional Classes

Food Additives -> ACIDITY_REGULATOR; SEQUESTRANT -> JECFA Functional Classes

Food Additives -> ACIDITY_REGULATOR; SEQUESTRANT -> JECFA Functional Classes

General Manufacturing Information · 2 Einträge

Plastics Product Manufacturing

1,2,3-Propanetricarboxylic acid, 2-hydroxy-, sodium salt (1:1): ACTIVE

Zugehörige Reaktionen

7
Reaktionsaufzeichnung erstellen
Reaktionsgleichung von HRID 36553
HRID 36553als Produktuspto-grants-1995_05
Reaktionsgleichung von HRID 36554
HRID 36554als Produktuspto-grants-1995_05
Reaktionsgleichung von HRID 36555
HRID 36555als Produktuspto-grants-1995_05
Reaktionsgleichung von HRID 566268
HRID 566268als Eduktuspto-grants-2001_01
Reaktionsgleichung von HRID 887987
HRID 887987als Eduktuspto-grants-2012_08
Reaktionsgleichung von HRID 1638163
HRID 1638163als Eduktuspto-grants-2000_03
Reaktionsgleichung von HRID 1775142
HRID 1775142als Eduktuspto-grants-2016_02

Notizen zur Verbindung

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Geruch (Odor)
Odorless
PH
4.07 · 4.07(1 mM solution);3.87(10 mM solution);3.71(100 mM solution);3.48(1000 mM solution)
Wasserlöslichkeit
Soluble in water. Insoluble in ethanol.
BRN
3920246 · 3920246
Kosmetik-Inhaltsstoffe Funktionen
BUFFERING
InChI
InChI=1S/C6H8O7.Na.H/c7-3(8)1-6(13,5(11)12)2-4(9)10;;/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);;
InChIKey
JKYDHHIKDADVTE-UHFFFAOYSA-N
SMILES
C(O)(C(=O)O)(CC(=O)O)CC(=O)O.[NaH]
CAS Datenbank
18996 · 18996-35-5(CAS DataBase Reference)
EPA chemische Informationen
1 · 1,2,3-Propanetricarboxylic acid, 2-hydroxy-, monosodium salt (18996-35-5)
Protective Action Criteria (PAC) · 3 Einträge

9.0 [mg/m3]

99 [mg/m3]

590 [mg/m3]

Toxikologische Informationen

Toxicity SummarySafe in the present practices of use and concentration. Ingredient, concentration, and use information are available in documents discoverable at https://cir-reports.cir-safety.org

Sicherheitsdaten

F
3
wgk
1
tsca
TSCA listed
hs_code
29181500
RTECS-Nr.
GE7950000
risk_code
36
hazard_code
Xi
safety_code
22-24/25
Speicherklasse
11 - Combustible Solids
Anwendungen · 2 Einträge

BeschreibungMono sodium citrate, or sodium dihydrogen citrate, is an acid salt with the chemical formula NaH2C6H5O7, or C3H4OH(COOH)2COONa. Since it has two remaining open spots on the citrate anion, it is used as a relatively strong sequestrant. It is used to prevent platelet clumping in blood samples. It is one of the 3 citric acid salts.

VerwendenSodium dihydrogen citrate acts as a buffering agent and sequestrant. It is also employed as a reductant and stabilizer in the preparation of b>Fe3O4 platinum core/shell particles. Further, it is used in electrochemical reduction of proton at carbon fiber electrode in the presence and absence of platinum nanoparticles. In addition to this, it plays a useful role in characterization of carbon-based electrode materials as cathode in half-cell configuration.

Darstellung

synthetischeMonosodium citrate can be prepared by the direct reaction of sodium carbonate or bicarbonate with citric acid: NaHCO3(s) + C6H8O7 (aq) → NaC6H7O7 (aq) + CO2 (g) + H2O (l).

Vor- und nachgelagerte Produkte

Vorgelagerte Rohstoffe

Limonin(SH)Natriumhydrogencarbonat