Natrium-2-ethylhexanoat
Sodium 2-ethylhexanoate
Grundinformationen
- CAS
19766-89-3- Standard-SMILES
CCCCC(CC)C(=O)[O-].[Na+]- InChIKey
VYPDUQYOLCLEGS-UHFFFAOYSA-M- Summenformel
- C8H15NaO2
- Durchschnittliche Molmasse
- 166,19 g/mol
- Monoisotopische Masse
- 166,096974
Namen und Bezeichner
- Bevorzugter Name
- Sodium 2-ethylhexanoate
- IUPAC
- sodium 2-ethylhexanoate
- Lokaler Name
- Natrium-2-ethylhexanoat
- Englischer Name
- Sodium 2-ethylhexanoate
- Summenformel
- C8H17NaO2
- Molmasse
- 168.21
Namen und Synonyme
Sodium 2-ethylhexanoateHexanoic acid, 2-ethyl-, sodium salt2-Ethylhexanoic acid sodium saltHexanoic acid, 2-ethyl-, sodium salt (1:1)2-Ethylcaproic acid sodium saltSodium-2-ethylcaproatesodium 2-ethylcaproateEINECS 243-283-8UNII-3I6Q454M3J3I6Q454M3JJ225.270HDTXSID0044866
Weitere Namen anzeigen
SODIUM ISOOCTANOATEsodium 2-ethylhexaoate2-EthylcaproicSODIUM 2-ETHYL HEXONATEAK159156sodium 2etSodium 2-ethyLUNII:3I6Q454M3JSodium 2-ethylhexano
EC 243-283-8RefChem:183613DTXCID8024866243-283-819766-89-3sodium;2-ethylhexanoateMFCD00014007SCHEMBL56210
Datenbank-Bezeichner
- CAS
19766-89-3- PubChem CID
- 23672331
- DTXSID
DTXSID0044866- ChEMBL
CHEMBL1762647- UNII
- 3I6Q454M3J
- EC Number
- 243-283-8
- Nikkaji
- J225.270H
Eigenschaften
Berechnete Struktureigenschaften
- Polarare Oberfläche (TPSA)
- 40,1 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 5
- Schwere Atome
- 11
- Formalladung
- 0
- Komplexität
- 104
Experimentelle und physikochemische Eigenschaften
Physical DescriptionLiquid
Physikochemische Eigenschaften
- Schmelzpunkt
- 300 °C · >300 °C (lit.)
- Siedepunkt
- 157 ℃[at · 157℃[at 101 325 Pa]
- Dichte
- 1.07 · 1.07[at 20℃]
- Dampfdruck
- 0 Pa · 0Pa at 20℃
- storage temp.
- Inert atmosphere,Room Temperature
- Löslichkeit
- Chloroform (Slightly), Methanol (Slightly)
- Aggregatzustand
- Solid
- pka
- 4.82 · 4.82[at 20 ℃]
- Farbe
- White to Off-White
- Wasserlöslichkeit
- Soluble in water.
- Stabilität
- hygroscopic
- InChI
- 1S/C8H16O2.Na/c1-3-5-6-7(4-2)8(9)10;/h7H,3-6H2,1-2H3,(H,9,10);/q;+1/p-1
- InChIKey
- VYPDUQYOLCLEGS-UHFFFAOYSA-M
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
This chemical does not meet GHS hazard criteria for 17.5% (53 of 303) of reports.
Danger
H315 (17.5%): Causes skin irritation [Warning Skin corrosion/irritation]
P203, P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P318, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 303 reports by companies from 16 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory Information
Hexanoic acid, 2-ethyl-, sodium salt (1:1) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Hexanoic acid, 2-ethyl-, 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: 25-05-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/11362
Hexanoic acid, 2-ethyl-, sodium salt: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazard Classes and CategoriesSkin Irrit. 2 (17.5%)
Sicherheitsdaten
- wgk
- 3
- tsca
- TSCA listed
- hs_code
- 29159000
- RTECS-Nr.
- MO7855000
- risk_code
- 36/37/38
- hazard_code
Chemie und Industrie
Verwendung und Herstellung
U.S. Production2023: 1,000,000 - <2,500,000 lb
Consumer UsesAnti-freeze agent
Industry UsesLubricating agent
Household ProductsInformation on 12 consumer products that contain Hexanoic acid, 2-ethyl-, sodium salt (1:1) in the following categories is provided:
General Manufacturing Information
All Other Basic Organic Chemical Manufacturing
Hexanoic acid, 2-ethyl-, sodium salt (1:1): ACTIVE
Anwendungen
VerwendenSodium 2-ethylhexanoate is useful in acylation of amines. It is an active ingredient in wood preservative agent. It is mainly used for synthetic 2-ethylhexanoic acid and calcium, magnesium salts. It is also used in salt forming agent of pharmaceutical, dry catalytic agent of the paint, polymer stabilizers, crosslinking agent, thickening agent of oil, and energy-saving additive of fuel.
Vor- und nachgelagerte Produkte
Vorgelagerte Rohstoffe
Nachgelagerte Produkte
Zugehörige Reaktionen
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