1,6-Dioxacyclododecan-7,12-dion

Adipic acid 1,4-butanediyl · 1，6-dioxyclodecane-7，12-dione · 1,6-dioxacyclododecane-7,12-dione · Adipic acid butane-1,4-diyl ester · Adipic acid (butane-1,4-diyl) ester

https://huagongshe.com/de/chemical/13064

Molekülstruktur von 1,6-Dioxacyclododecan-7,12-dion

Identifikatoren & physikalische Daten

CAS No.	777-95-7
Summenformel	C10H16O4
Durchschnittliche Molmasse	200,23 g/mol
Monoisotopische Masse	200,10485899 g/mol
SMILES	O=C1CCCCC(=O)OCCCCO1
InChIKey	AXKZIDYFAMKWSA-UHFFFAOYSA-N
PubChem CID	13064
EC No.	212-291-3
DTXSID	DTXSID70228330
Lokaler Name	1,6-Dioxacyclododecan-7,12-dion

Chemische & physikalische Eigenschaften

XLogP	1,1
Polarare Oberfläche (TPSA)	52,6
H-Brücken-Donoren	0
H-Brücken-Akzeptoren	4
Frei drehbare Bindungen	0
Schwere Atome	14
Formalladung	0
Komplexität	178
Food Contact Substances	FCS -> FDA Cumulative Estimated Daily Intake (CEDI)
Schmelzpunkt	90-93°C
Siedepunkt	422.3±38.0 °C(Predicted)
Dichte	1.065±0.06 g/cm3(Predicted)
Lagerbedingungen	Refrigerator
Löslichkeit	Chloroform (Slightly), Ethanol (Slightly), Ethyl Acetate (Slightly)
Aggregatzustand	Solid
Farbe	White to Pale Yellow

Sicherheit & Vorschriften

GHS-Einstufung	WarningH303 (100%): May be harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P271, P280, P301+P317, 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 Categories	Acute Tox. 5 (100%)
Alarmwort	Warnung
Gefahrenhinweise	Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H303

Anwendungen & Verwendung

Verwenden

1,6-Dioxacyclododecane-7,12-dione, is on of the Macrocyclic compounds. It can be used in the preparation of other Symmetrical cyclic diesters and dilactones.