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Calciumdipropionat

Calcium propionate

HCID 19999
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Grundinformationen

CAS
4075-81-4
Standard-SMILES
CCC(=O)[O-].CCC(=O)[O-].[Ca+2]
InChIKey
BCZXFFBUYPCTSJ-UHFFFAOYSA-L
Summenformel
C6H10O4Ca
Durchschnittliche Molmasse
186,22 g/mol
Monoisotopische Masse
186,02049978

Namen und Bezeichner

Bevorzugter Name
Calcium propionate
IUPAC
calcium propanoate
Lokaler Name
Calciumdipropionat
Englischer Name
Calcium Propionate
Summenformel
C3H8CaO2
Molmasse
116.17

Namen und Synonyme

CALCIUM PROPIONATE4075-81-4Calcium propanoatePropanoic acid, calcium saltBioban-CPropionic acid, calcium saltDTXSID1027556Propanoic acid, calcium salt (2:1)8AI80040KWDTXCID607556INS NO.282INS-282
Weitere Namen anzeigen
CALCIUM PROPIONATE POWDERCALCIUM PROPIONATE FOOD GRADEEncapsulated Calcium PropionateCAPROSIL SALZMAGNESIA 87264MAGGRAN(R) CPRCAPROSIL SALT G
E-282RefChem:122900223-795-8Calcium dipropionatecalcium;propanoatepropionic acid calciumPropionic acid calcium saltPropanoate (calcium)

Datenbank-Bezeichner

CAS
4075-81-4
PubChem CID
19999
DTXSID
DTXSID1027556
ChEMBL
CHEMBL3186661
UNII
8AI80040KW
EC Number
223-795-8
Nikkaji
J3.064C

Eigenschaften

Berechnete Struktureigenschaften

Polarare Oberfläche (TPSA)
80,3 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
4
Frei drehbare Bindungen
0
Schwere Atome
11
Formalladung
0
Komplexität
34,6

Experimentelle und physikochemische Eigenschaften

Chemical ClassesMetals -> Metals, Inorganic Compounds
CosmeticsPreservative
pH6,0-9,0 (10 % aqueous solution)
Pesticides · 2 Einträge

Fungicides

Active substance -> EU Pesticides database: Not approved

Food AdditivesANTIMICROBIAL AGENT, ANTIOXIDANT -> FDA Substance added to food
Color/Form · 3 Einträge

COLORLESS, MONOCLINIC TABLETS

Powder or monoclinic crystals

White powder

Solubility · 3 Einträge

SOLUBILITY IN 49 G/100 CC WATER @ 0 °C; 55.8 G/100 CC WATER @ 100 °C /HYDRATE/

Sol in water; slightly sol in methanol, ethanol; practically insol in acetone, benzene.

INSOL IN ALCOHOL

DecompositionWhen heated to decomposition it emits acrid smoke and irritating fumes.
Physical Description · 3 Einträge

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 · 6 Einträge

This chemical does not meet GHS hazard criteria for 20.5% (69 of 337) of reports.

Danger

H318 (78.6%): Causes serious eye damage [Danger Serious eye damage/eye irritation]

P264+P265, P280, P305+P354+P338, and P317 (click each P-code to see the statement)

Aggregated GHS information provided per 337 reports by companies from 7 notifications to the ECHA C&L Inventory.

Danger

Gefahrenhinweise

Regulatory Information · 6 Einträge

Chemical: Propanoic acid, calcium salt

Regulation (EC) No 257/2010

Propanoic acid, calcium salt (2:1) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Propanoic acid, calcium salt (2:1) 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)

Reg. (EU) 2022/1443

Status: Active Update: 17-11-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/5706

Calcium propionate: Does not have an individual approval but may be used under an appropriate group standard

Other Safety InformationIMAP assessments - Propanoates: Human health tier II assessment
Hazards SummaryGenerally treated as a non-toxic ingestion; Classified as generally recognized as safe (GRAS) when used in food; [HSDB] Oral LD50 (rat) = 3920 mg/kg; [Sax] May cause irritation; [MSDSonline] See Calcium.
FDA RequirementsSubstance added directly to human food affirmed as generally recognized as safe (GRAS).
FIFRA Requirements · 1 Eintrag

Chemie und Industrie

Pharmakologische Informationen

Metabolism/MetabolitesPROPIONATE IS METABOLIZED LIKE OTHER FATTY ACIDS IN THE MAMMALIAN BODY ... /PROPIONATE/

Verwendung und Herstellung

Uses · 6 Einträge

Used as a preservative in foods, tobacco, feed grain, cosmetics, and pharmaceuticals; Has been used in the production of butyl rubber and as an antifungal drug; [HSDB]

Farming (Feed Additives) [Category: Industry]

Active ingredient (AI): Calcium propionate; AI Status: Cancelled - The active ingredient is no longer contained in any registered pesticide product.

Inhibitor of molds & other microorganisms in foods, tobacco, pharmaceuticals; in butyl rubber to improve processability and scorching resistance.

THERAP CAT: Antifungal agent

Feed grain preservative

U.S. Exports · 2 Einträge

(1972) NEGLIGIBLE

(1975) NEGLIGIBLE

U.S. Imports · 3 Einträge

(1972) NEGLIGIBLE

(1975) NEGLIGIBLE

(1984) 7.56X10+7 g /propionates/

U.S. Production · 5 Einträge

2023: 250,000 - <400,000 lb

(1972) 9.71X10+9 GRAMS

(1975) PROBABLY GREATER THAN 9.08X10+5 GRAMS

(1984) 8.51X10+9 g

(1993) 16,382 kg

Consumption Patterns · 2 Einträge

ABOUT 80% AS AN ANTIFUNGAL FOOD ADDITIVE IN BAKED GOODS, MOSTLY IN BREAD; ABOUT 20% AS AN ANTIFUNGAL AGENT IN OTHER APPLICATIONS, PRINCPLY AS AN ADDITIVE IN PROCESSED CHEESE (1973)

Mold inhibitor-Baked goods, 80%; Feed grain preservative, 10%; and Misc, 10% (1983) /Sodium & calcium propionate/

Consumer UsesProcessing aids not otherwise specified
Industry Uses

Zugehörige Reaktionen

7
Reaktionsaufzeichnung erstellen
Reaktionsgleichung von HRID 258176
HRID 258176als Produktuspto-grants-1993_11
Reaktionsgleichung von HRID 258177
HRID 258177als Produktuspto-grants-1993_11
Reaktionsgleichung von HRID 435424
HRID 435424als Produktuspto-grants-1983_08
Reaktionsgleichung von HRID 1611224
HRID 1611224als Produktuspto-grants-2006_01
Reaktionsgleichung von HRID 1838675
HRID 1838675als Produktuspto-grants-2004_01
Reaktionsgleichung von HRID 1838676
HRID 1838676als Produktuspto-grants-2004_01
Reaktionsgleichung von HRID 2121069
HRID 2121069als Eduktuspto-grants-2004_02

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Dry Powder; CBI; Liquid

White crystalline powder

Colorless or white Solid; Soluble in water; [HSDB] White powder; Soluble in water; [MSDSonline]

Other Experimental PropertiesOccurs as mono- or trihydrate

Physikochemische Eigenschaften

Schmelzpunkt
300 °C · 300 °C
Dichte
1.41 · 1.41[at 20℃]
Dampfdruck
0 · 0-399Pa at 20-23℃
storage temp.
30 °C · Store below +30°C.
Löslichkeit
1 g/10 · water: soluble1g/10 mL, clear, colorless
Aggregatzustand
Crystals or Crystalline Powder
Farbe
White
PH
9.2 · 9.2 (200g/l, H2O, 20℃)(IUCLID)
Geruch (Odor)
100 % · at 100.00%. bland mild propionic acid
Wasserlöslichkeit
1 g/10 · 1 g/10 mL
Merck
14 · 14,1698
BRN
3698682 · 3698682
Stabilität
Stable. Hygroscopic. Incompatible with strong oxidizing agents.
Kosmetik-Inhaltsstoffe Funktionen
PRESERVATIVE
InChI
1S/2C3H6O2.Ca/c2*1-2-3(4)5;/h2*2H2,1H3,(H,4,5);/q;;+2/p-2
InChIKey
BCZXFFBUYPCTSJ-UHFFFAOYSA-L
SMILES
CCC(=O)O[Ca]OC(=O)CC
LogP
0.33 at · 0.33 at 25℃
CAS Datenbank
4075 · 4075-81-4(CAS DataBase Reference)
EPA chemische Informationen
Calcium propionate (4075-81-4)

As the federal pesticide law FIFRA direct, EPA is conducting a comprehensive review of older pesticides to consider their health and environmental effects and make decisions about their future use. Under this pesticide reregistration program, EPA examines health and safety data for pesticide active ingredients initially registered before November 1, 1984, and determines whether they are eligible for reregistration. In addition, all pesticides must meet the new safety standard of the Food Quality Protection Act of 1996. Pesticides for which EPA had not issued Registration Standards prior to the effective date of FIFRA 88 were divided into three lists based upon their potential for human exposure and other factors, with List B containing pesticides of greater concern and List D pesticides of less concern. Calcium propionate is found on List D. Case No: 4078; Case Status: RED Approved 09/91 - OPP has made a decision that some/all uses of the pesticide are eligible for reregistration, as reflected in a Reregistration Eligibility Decision (RED) Document. Active ingredient (AI): Calcium propionate; AI Status: Cancelled - The active ingredient is no longer contained in any registered pesticide product. Thus, we characterize it as cancelled.

Hazard Classes and Categories · 2 Einträge

Eye Dam. 1 (78.6%)

Eye damage - category 1

Sicherheit und Schutzausrüstung

Storage ConditionsSODIUM AND CALCIUM PROPIONATES ... PRESENT LITTLE HAZARD IN STORAGE.
Disposal Methods · 1 Eintrag

SRP: At the time of review, criteria for land treatment or burial (sanitary landfill) disposal practices are subject to significant revision. Prior to implementing land disposal of waste residue (including waste sludge), consult with environmental regulatory agencies for guidance on acceptable disposal practices.

Toxikologische Informationen

Non-Human Toxicity Excerpts · 2 Einträge

/IN RATS/ SODIUM OR CALCIUM PROPIONATE HAD NO EFFECT ON GROWTH WHEN FED AT LEVELS OF 1 TO 3 G DAILY, FOR 4 TO 5 WK, BEGINNING WHEN ANIMALS WERE ABOUT 4 WK OF AGE.

... A LEVEL OF 5% /SODIUM OR CALCIUM/ PROPIONATE WAS PLACED IN BREAD BEFORE BAKING AND ... FED AS THREE-FOURTHS OF DIET OF RATS FOR ONE YEAR. THERE WAS NO DISCERNIBLE TOXICITY IN SPITE OF PRESENCE OF THREE OTHER ... ADDITIVES AT HIGH CONCN IN DIET.

Non-Human Toxicity Values · 2 Einträge

LD50 Rat oral 3920 mg/kg

LD50 Mouse oral 2350 mg/kg

Regulatorische Informationen

FDA RequirementsSubstance added directly to human food affirmed as generally recognized as safe (GRAS).
FIFRA Requirements · 1 Eintrag

As the federal pesticide law FIFRA direct, EPA is conducting a comprehensive review of older pesticides to consider their health and environmental effects and make decisions about their future use. Under this pesticide reregistration program, EPA examines health and safety data for pesticide active ingredients initially registered before November 1, 1984, and determines whether they are eligible for reregistration. In addition, all pesticides must meet the new safety standard of the Food Quality Protection Act of 1996. Pesticides for which EPA had not issued Registration Standards prior to the effective date of FIFRA 88 were divided into three lists based upon their potential for human exposure and other factors, with List B containing pesticides of greater concern and List D pesticides of less concern. Calcium propionate is found on List D. Case No: 4078; Case Status: RED Approved 09/91 - OPP has made a decision that some/all uses of the pesticide are eligible for reregistration, as reflected in a Reregistration Eligibility Decision (RED) Document. Active ingredient (AI): Calcium propionate; AI Status: Cancelled - The active ingredient is no longer contained in any registered pesticide product. Thus, we characterize it as cancelled.

Sicherheitsdaten

wgk
2
tsca
TSCA listed
hs_code
29155000
RTECS-Nr.
UE8450000
risk_code
36/37/38
safety_code
24/25
Speicherklasse
11 - Combustible Solids
Giftige Stoffe Daten
4075-81-4(Hazardous Substances Data)
Hazard Classifications
Eye Dam. 1STOT SE 3
pH regulating agent
Methods of ManufacturingPropionic acid + calcium hydroxide (salt formation)
Formulations/PreparationsGrade: FCC
Use Classification · 4 Einträge

Food additives

Food Additives -> PRESERVATIVE -> JECFA Functional Classes

Food Additives -> PRESERVATIVE -> JECFA Functional Classes

Cosmetics -> Preservative

General Manufacturing Information · 6 Einträge

Food, beverage, and tobacco product manufacturing

Propanoic acid, calcium salt (2:1): ACTIVE

PROPIONATE COMPOUND IS A MIXTURE CONTAINING 10% EACH OF CALCIUM AND SODIUM PROPIONATES IN A JELLY FOR LOCAL APPLICATION. ... IS USED IN TREATMENT OF VULVOVAGINAL MONILIASIS.

BECAUSE PROPIONATE INHIBITS MOLD AND SPARES YEAST, IT HAS SUPERSEDED THE ACID PHOSPHATE AS AN ANTI-ROPE AGENT. /PROPIONATE/

... FOUND THAT BREAD WHICH CONTAINED 0.2% OF PROPIONATE (BASIS TOTAL DOUGH WEIGHT) SHOWED NO VISIBLE MOLD FOR OVER 8 DAYS IN BOTH WRAPPED AND UNWRAPPED CONDITION AT ROOM TEMP. /PROPIONATE/

... REPORTED THAT, FOR BREAD, 0.2% ... BY FLOUR WT EXTENDED MOLD-FREE LIFE TO SIX DAYS, AS COMPARED WITH FOUR DAYS FOR UNTREATED LOAVES. NO ODOR PROBLEMS WERE FOUND AT THIS LEVEL.

Anwendungen · 2 Einträge

BeschreibungCalcium propanoate or calcium propionate has the formula Ca(C2H5COO)2. It is the calcium salt of propanoic acid. It is a preservative commonly used in baked goods around the world, where it extends their shelf life by inhibiting the growth of spoilage microorganisms, namely mold and ropy bacteria.

VerwendenCalcium Propionate is the salt of propionic acid which functions as a preservative. It is the most widely used antimycotic in breadmaking. it is effective against mold, has limited activity against bacteria, and no activity against yeast. it is soluble in water with a solubility of 49 g/100 ml of water at 0°c and insoluble in alcohol. it is less soluble than sodium propionate. its optimum effectiveness is up to ph 5.0 and it has reduced action above ph 6.0. It is often utilized at about 0.2%, flour basis; higher concentrations lead to flavor problems and begin to inhibit yeast fermentation. it is used in bakery products, breads, and pizza crust to protect against mold and “rope.” it is also used in cold-pack cheese food and pie fillings. typical usage level is 0.2–0.3% and 0.1–0.4% based on flour weight.

Darstellung

synthetischeThe industrial production of Calcium propionate and sodium propionate is carried out by the neutralization of propionic acid with the corresponding hydroxides and subsequent spraydrying of the concentrated aqueous solutions.

Vor- und nachgelagerte Produkte

Vorgelagerte Rohstoffe

CalciumcarbonatPropionsureCalciumdihydroxidPropionitrilPropionamid

Nachgelagerte Produkte

Calciumpantothenat , D-Form