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HCID 98501Erstellt: 27. Oktober 2026

Bicyclo[4.4.0]decan-1-on

octahydronaphthalen-1(2H)-one · 1-decalone, mixture of cis and trans · Ai3-06188 · 1-DECALONE · Einecs 225-410-9 · 1-DECALONE (CIS-TRANS) · BICYCLO(4.4.0)-2-DECANONE · DECAHYDRO-1-NAPHTHALENONE

https://huagongshe.com/de/chemical/98501

Molekülstruktur von Bicyclo[4.4.0]decan-1-on

Identifikatoren & physikalische Daten

CAS No.4832-16-0
SummenformelC10H16O
Durchschnittliche Molmasse152,23 g/mol
Monoisotopische Masse152,12011513 g/mol
SMILESO=C1CCCC2CCCCC12
InChIKeyAFEFRXAPJRCTOW-UHFFFAOYSA-N
PubChem CID98501
EC No.225-410-9
DTXSIDDTXSID90871322
Lokaler NameBicyclo[4.4.0]decan-1-on

Chemische & physikalische Eigenschaften

XLogP2,6
Polarare Oberfläche (TPSA)17,1
H-Brücken-Donoren0
H-Brücken-Akzeptoren1
Frei drehbare Bindungen0
Schwere Atome11
Formalladung0
Komplexität162
Siedepunkt73-75 °C1 mm Hg(lit.)
Dichte0.986 g/mL at 25 °C(lit.)
Brechungsindexn20/D 1.492(lit.)
Flammpunkt190 °F
Aggregatzustandliquid
InChI1S/C10H16O/c11-10-7-3-5-8-4-1-2-6-9(8)10/h8-9H,1-7H2
InChIKeyAFEFRXAPJRCTOW-UHFFFAOYSA-N
SMILESO=C1CCCC2CCCCC12

Sicherheit & Vorschriften

GHS-EinstufungWarningH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Wassergefährdungsklasse (WGK)3
R-Sätze (R)52/53
Sicherheitshinweise (S)61
Lagerklasse10 - Combustible liquids

Anwendungen & Verwendung

Verwenden

trans-1-decalone was used as a substrate for the ketoreductase of the diketide synthase. cis-1-Decalone was used in the preparation of [cis-cis-1-decalyl glucosid]-uronic acid.