4-Ethoxybenzaldehyde (HCID 24834)

Überblick

4-ethoxybenzaldehyde is an aromatic ether.

Namen und Bezeichner

Bevorzugter Name: 4-Ethoxybenzaldehyde
IUPAC: 4-ethoxybenzaldehyde
Lokaler Name: 4-Ethoxybenzaldehyd
Englischer Name: 4-Ethoxybenzaldehyde
Summenformel: C9H10O2
Molmasse: 150.17

Namen und Synonyme

4-ETHOXYBENZALDEHYDE10031-82-0p-EthoxybenzaldehydeBenzaldehyde, 4-ethoxy-Ethoxybenzaldehyde, p-FEMA No. 2413UNII-GOW1H0F49AEINECS 233-093-3GOW1H0F49ANSC 406709BRN 0386863p-Ethoxy benzaldehyde

Weitere Namen anzeigen

FEMA 2413HomoanisaldehydeAKOS BBS-00003167Ethoxybenzaldehydep-ethoxy-benzaldehyd4-ethoxy-benzaldehydP-ETHYOXYBENZALDEHYDEOTAVA-BB BB7020401735

AI3-05684P-ETHOXYBENZALDEHYDE [FHFI]NSC-406709DTXSID70222514-08-00-00254 (Beilstein Handbook Reference)RefChem:98835DTXCID5022514-ETHOXYBENZALDEHYDE [INCI]

Datenbank-Bezeichner

CAS: 10031-82-0
PubChem CID: 24834
DTXSID: DTXSID7022251
ChEBI: CHEBI:167817
UNII: GOW1H0F49A
EC Number: 233-093-3
Nikkaji: J38.403H

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 1,6
Polarare Oberfläche (TPSA): 26,3 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 3
Schwere Atome: 11
Formalladung: 0
Komplexität: 115

Experimentelle und physikochemische Eigenschaften

SpringerMaterials PropertiesDiamagnetic susceptibility

LogP · 2 Einträge

2.230

2.09

Food AdditivesFLAVORING AGENT OR ADJUVANT -> FDA Substance added to food

Density1.078-1.084

Flavoring AgentsEU Flavoring substances

Solubility · 3 Einträge

slightly

poorly soluble in water, glycols, glycerol; soluble in organic solvents, oils

miscible at room temperature (in ethanol)

Physikochemische Eigenschaften

Schmelzpunkt: 13 · 13-14 °C(lit.)
Siedepunkt: 255 °C · 255 °C(lit.)
Dichte: 1.08 g/mL · 1.08 g/mL at 25 °C(lit.)
Brechungsindex: 20 · n20/D 1.559(lit.)
FEMA: 2413 · 2413 | P-ETHOXYBENZALDEHYDE
Flammpunkt: 230 °F · >230 °F
storage temp.: 2 · under inert gas (nitrogen or Argon) at 2-8°C
Aggregatzustand: Liquid
Wichte: 1.08 · 1.08
Farbe: Clear yellow to light brown
Geruch (Odor): 100 % · at 100.00 %. sweet spicy floral anisic
Geruchsart: spicy
Wasserlöslichkeit: Insoluble in water.
JECFA Number: 879 · 879
BRN: 386863 · 386863
Kosmetik-Inhaltsstoffe Funktionen: PERFUMINGFRAGRANCE
InChI: 1S/C9H10O2/c1-2-11-9-5-3-8(7-10)4-6-9/h3-7H,2H2,1H3
InChIKey: JRHHJNMASOIRDS-UHFFFAOYSA-N
SMILES: [H]C(=O)c1ccc(OCC)cc1
LogP: 2.23 · 2.23
CAS Datenbank: 10031 · 10031-82-0(CAS DataBase Reference)
NIST chemische Informationen: 4 · Benzaldehyde, 4-ethoxy-(10031-82-0)
EPA chemische Informationen: 4 · Benzaldehyde, 4-ethoxy- (10031-82-0)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)

Aggregated GHS information provided per 1589 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Regulatory Information · 3 Einträge

Chemical: Benzaldehyde, 4-ethoxy-

Commission Regulation (EC) No 1565/2000 (Repealed by Com. Implementing Reg. (EU) No 872/2012)

4-Ethoxybenzaldehyde: Does not have an individual approval but may be used under an appropriate group standard

Hazard Classes and CategoriesSkin Irrit. 2 (100%)

Sicherheitsdaten

wgk: 3
tsca: TSCA listed
hs_code: 29124990
RTECS-Nr.: CU6100000
risk_code: 36/37/38
hazard_code: Xi
hazard_note: Irritant
safety_code: 26-37/39-24/25-36
Speicherklasse: 10 - Combustible liquids
Hazard Classifications: Eye Irrit. 2Skin Irrit. 2STOT SE 3

Chemie und Industrie

Pharmakologische Informationen

Cellular LocationsCytoplasm

Verwendung und Herstellung

Use Classification · 3 Einträge

Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

Flavoring Agents -> JECFA Flavorings Index

Flavouring Agent -> FLAVOURING_AGENT -> JECFA Functional Classes

General Manufacturing InformationBenzaldehyde, 4-ethoxy-: ACTIVE

Anwendungen · 3 Einträge

Beschreibung4-Ethoxybenzaldehyde is a flavoring ingredient. 4-Ethoxybenzaldehyde can be used as an anti-inflammatory and prostaglandin E2 suppressor. It has also been indicated that it is useful in reducing facial erythema.

OccurrenceReported found in black tea

Verwenden4-Ethoxybenzaldehyde was used as an anti-inflammatory and prostaglandin E2 suppressor in skin lightening agents.

Darstellung

synthetischeBy ethylation of p-hydroxybenzaldehyde using aluminum chloride catalyst.

Vor- und nachgelagerte Produkte

Vorgelagerte Rohstoffe

Nachgelagerte Produkte

2-[2-[4-[(4-Ethoxyphenyl)methylamino]phenyl]vinyl]-5-(methoxycarbonyl)-1,3,3-trimethyl-3H-indoliumchlorid 4-Ethoxycinnamic acid 4-Ethoxybenzoesure 2-((4-Ethoxybenzyl)amino)ethanol 2'-(4'-Ethoxyphenyl)-5-(4-methylpiperazin-1-yl)-2,5'-bis-1H-benzimidazoltrihydrochloridtrihydrat 4-Ethoxyphenol 4-Ethoxybenzonitrile Methyl-4-ethoxybenzoat Benzene, 1-ethoxy-4-(2-nitro-1-propenyl)-, (E)- (9CI)[(Z)-[(4-ethoxyphenyl)methylidene]amino]thiourea 5-(4-Ethoxy-phenyl)-[1,3,4]oxadiazol-2-ylamine Benzyl-(4-ethoxy-benzyl)-amine

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