2,2'-[(1-Methylethyliden)bis(4,1-phenylenoxymethylen)]bisoxiran

Bisphenol A diglycidyl ether

HCID 2286CAS 1675-54-3

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Grundinformationen

Standard-SMILES: CC(C)(c1ccc(OCC2CO2)cc1)c1ccc(OCC2CO2)cc1
InChIKey: LCFVJGUPQDGYKZ-UHFFFAOYSA-N
Summenformel: C21H24O4
Durchschnittliche Molmasse: 340,4 g/mol
Monoisotopische Masse: 340,16745924

Namen und Bezeichner

Bevorzugter Name: Bisphenol A diglycidyl ether
IUPAC: 2-[[4-[2-[4-(oxiran-2-ylmethoxy)phenyl]propan-2-yl]phenoxy]methyl]oxirane
Lokaler Name: 2,2'-[(1-Methylethyliden)bis(4,1-phenylenoxymethylen)]bisoxiran
Englischer Name: BISPHENOL A DIGLYCIDYL ETHER RESIN
Summenformel: C21H24O4
Molmasse: 340.41

Namen und Synonyme

BISPHENOL A DIGLYCIDYL ETHER1675-54-3BADGE2,2-Bis(4-glycidyloxyphenyl)propaneEpoxide ADiglycidyl bisphenol AEpophen EL 5DGEBADGEBPADian diglycidyl etherDiglycidyl bisphenol A etherDiomethane diglycidyl ether

Weitere Namen anzeigen

Epon 828der332E-44DER 332 RESINEPON(R) RESIN 828Bisphenol-A epoxy resin E512,2'-(((propane-2,2-diylbis(4,1-phenylene))bis(oxy))bis(Methylene))bis(oxirane)

Bpdgeepi-Rez 5102,2-Bis(4'-glycidyloxyphenyl)propaneDiglycidyl ether of bisphenol A2,2-Bis(p-glycidyloxyphenyl)propaneDiglycidyl diphenylolpropane ether4,4'-Isopropylidenediphenol diglycidyl etherBis(4-glycidyloxyphenyl)dimethylmethane

Datenbank-Bezeichner

CAS: 1675-54-3、25085-99-8
PubChem CID: 2286
DTXSID: DTXSID6024624
ChEMBL: CHEMBL258558
ChEBI: CHEBI:34578
UNII: F3XRM1NX4H
EC Number: 216-823-5
Nikkaji: J14.164J

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 4
Polarare Oberfläche (TPSA): 43,5 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 4
Frei drehbare Bindungen: 8
Schwere Atome: 25
Formalladung: 0
Komplexität: 384

Physikochemische Eigenschaften

Schmelzpunkt: 40 · 40-44 °C
Siedepunkt: 210 °C · 210 °C / 1mmHg
Dichte: 1 · 1,17 g/cm3
Dampfdruck: 0 Pa · 0Pa at 25℃
Brechungsindex: 1.5735 · 1.5735
Flammpunkt: 264 · 264-268°
storage temp.: 2 · Inert atmosphere,2-8°C
Löslichkeit: Soluble in DMSO (up to 30 mg/ml) or in Ethanol (up to 15 mg/ml)
Aggregatzustand: viscous liquid
Farbe: White
Wasserlöslichkeit: 100 % · Soluble in 100% ethanol, dimethyl sulfoxide (100 mM), dimethyl formamide, chloroform, methanol, and ethanol (50 mM). Insoluble in water.
BRN: 299026 · 299026
Henry's Law Constant: 2.2 · 2.2×105 mol/(m3Pa) at 25℃, HSDB (2015)
Stabilität: 1 year · Stable for 1 year from date of purchase as supplied. Solutions in DMSO or ethanol may be stored at -20°C for up to 1 month.
Major Application: cleaning productscosmeticsfood and beveragespersonal care
InChI: 1S/C21H24O4/c1-21(2,15-3-7-17(8-4-15)22-11-19-13-24-19)16-5-9-18(10-6-16)23-12-20-14-25-20/h3-10,19-20H,11-14H2,1-2H3
InChIKey: LCFVJGUPQDGYKZ-UHFFFAOYSA-N
SMILES: CC(C)(c1ccc(OCC2CO2)cc1)c3ccc(OCC4CO4)cc3
LogP: 3.242 at · 3.242 at 25℃
CAS Datenbank: 1675 · 1675-54-3(CAS DataBase Reference)
EPA chemische Informationen: Bisphenol A diglycidyl ether (1675-54-3)

Sicherheit und Regulatorisches

Sicherheitsdaten

wgk: 1
tsca: TSCA listed
hs_code: 2910900090
RTECS-Nr.: TX3800000
risk_code: 36/38-43
Toxizität: LD50 oral in rabbit: 1980mg/kg
hazard_code: Xi
safety_code: 28-37/39
Speicherklasse: 10 - Combustible liquids
Giftige Stoffe Daten: 1675-54-3(Hazardous Substances Data)
Hazard Classifications: Aquatic Chronic 2Eye Irrit. 2Skin Irrit. 2Skin Sens. 1

Chemie und Industrie

Anwendungen · 2 Einträge

BeschreibungMost epoxy resins result from polymerization of bisphenol A diglycidyl ether (BADGE). Delayed hypersensitivity is caused by the low-molecular-weight monomer BADGE (MW 340 g/mol), the dimer having a much lower sensitization power. This allergen caused contact dermatitis in six workers in a plant producing printed circuits boards made of copper sheets and fiberglass fabric impregnated with a brominated epoxy resin. It can also be contained in adhesives.

VerwendenBisphenol A derivative. A PPARγ antagonist; exhibits estrogenic activity; An inhibitor of PPARγ and suppressor of TNFα.