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HCID 25311Erstellt: 26. Oktober 2026

Tridecanal

N-TRIDECANAL · 1-Tridecanal · AVALONE M · TRIDECANAL · 1-Tridecanone · Tridecanal >TRIDECANAL 95+% · Tridecanaldehyde · TRIDECYLALDEHYDE

https://huagongshe.com/de/chemical/25311

Molekülstruktur von Tridecanal

Identifikatoren & physikalische Daten

CAS No.10486-19-8
SummenformelC13H26O
Durchschnittliche Molmasse198,34 g/mol
Monoisotopische Masse198,19836545 g/mol
SMILESCCCCCCCCCCCCC=O
InChIKeyBGEHHAVMRVXCGR-UHFFFAOYSA-N
PubChem CID25311
ChEMBLCHEMBL2228568
ChEBICHEBI:89816
EC No.234-004-0
DTXSIDDTXSID4021682
Lokaler NameTridecanal

Chemische & physikalische Eigenschaften

XLogP5,4
Polarare Oberfläche (TPSA)17,1
H-Brücken-Donoren0
H-Brücken-Akzeptoren1
Frei drehbare Bindungen11
Schwere Atome14
Formalladung0
Komplexität110
StoffklassenOther Classes -> Aldehydes
LipideFatty Acyls [FA] -> Fatty aldehydes [FA06]
SpringerMaterials PropertiesBoiling point
DuftstoffeFragrance Ingredient (Tridecanal) -> IFRA transparency List
LebensmittelzusatzstoffeFLAVORING AGENT OR ADJUVANT -> FDA Substance added to food
Siedepunkt132.00 to 136.00 °C. @ 8.00 mm Hg132-136 °C8 mm Hg(lit.)
Schmelzpunkt14 °C15°C
Physical DescriptionMelting point = 14 deg C[ChemIDplus] Liquid[Alfa Aesar MSDS]
Dichte0.835 g/mL at 25 °C(lit.)
Brechungsindexn20/D 1.437(lit.)
FEMA4335 | TRIDECANAL
Flammpunkt>230 °F
Lagerbedingungen2-8°C
LöslichkeitInsoluble in water
AggregatzustandLiquid
FarbeWhite or Colorless to Light yellow
Geruchat 1.00 % in dipropylene glycol. fresh clean aldehydic soapy citrus petal waxy grapefruit peel
Geruchsartaldehydic
Biologische Quellesynthetic
JECFA Number2301
Henry-Konstante5.8×10-3 mol/(m3Pa) at 25℃, Yaws (2003)
Hauptanwendungenflavors and fragrances
Kosmetik-Inhaltsstoffe FunktionenPERFUMING
InChI1S/C13H26O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14/h13H,2-12H2,1H3
InChIKeyBGEHHAVMRVXCGR-UHFFFAOYSA-N
SMILESCCCCCCCCCCCCC=O
LogP (Verteilungskoeffizient)5.69
CAS Datenbank10486-19-8(CAS DataBase Reference)
NIST chemische InformationenTridecanal(10486-19-8)
EPA chemische InformationenTridecanal (10486-19-8)

Sicherheit & Vorschriften

GHS-EinstufungDangerH314 (17.6%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]P260, P261, P264, P264+P265, P271, P273, P280, P301+P330+P331, P302+P352, P302+P361+P354, P304+P340, P305+P351+P338, P305+P354+P338, P316, P317, P319, P321, P332+P317, P337+P317, P362+P364, P363, P391, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 136 reports by companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Regulatorische InformationenChemical: TridecanalTridecanal: Does not have an individual approval but may be used under an appropriate group standard
GefahrenübersichtAn irritant[Alfa Aesar MSDS]
Peroxide Forming ChemicalTridecanalD*: Other compounds that may form peroxidesBretherick'sA mixture of isomers was reported to have ignited after extended contact with air. See Bretherick's.Steele, A. B. et al., Chem. Engrg., 1959, 66(4), 160
Hazard Classes and CategoriesSkin Corr. 1B (17.6%)
Wassergefährdungsklasse (WGK)3
TSCA-Inventar-StatusTSCA listed
Zollcode2912.19.5000
R-Sätze (R)36/37/38
GefahrensymboleXi
Sicherheitshinweise (S)26
Lagerklasse10 - Combustible liquids
GefahrenklasseEye Irrit. 2Skin Irrit. 2Skin Sens. 1STOT SE 3

Anwendungen & Verwendung

Occurrence

Reported found in angelica seed oil CO2 extract (0.50%), blood orange oil (Citrus senensis L. var. Sanguinello) Italy (trace), blood orange oil (Citrus senensis L. var. Tarocco) Italy (trace), blood orange oil Italy (trace), cistus oil (0.1%), coriander leaf oil (1.43–1.44%), Herniaria incana Lam. oil Greece (5.80%), orange peel oil sweet c.p. blond Italy (trace), and witch hazel leaf oil (0.24%).

Verwenden

Tridecanal is a model compound in the nonradioactive assay/RP-HPLC-fluorescence analysis of aliphatic aldehydes employing the Hantzsch reaction.