4,4'-(Dichlorvinyliden)diphenol

1,1-Bis(4-hydroxyphenyl)-2,2-dichloroethylene

HCID 84677CAS 14868-03-2

Teilstruktursuche Ähnliche Strukturen suchen

Grundinformationen

Standard-SMILES: Oc1ccc(C(=C(Cl)Cl)c2ccc(O)cc2)cc1
InChIKey: OWEYKIWAZBBXJK-UHFFFAOYSA-N
Summenformel: C14H10Cl2O2
Durchschnittliche Molmasse: 281,1 g/mol
Monoisotopische Masse: 280,0057849

Namen und Bezeichner

Bevorzugter Name: 1,1-Bis(4-hydroxyphenyl)-2,2-dichloroethylene
IUPAC: 4-[2,2-dichloro-1-(4-hydroxyphenyl)ethenyl]phenol
Lokaler Name: 4,4'-(Dichlorvinyliden)diphenol
Englischer Name: Bisphenol C
Summenformel: C14H10Cl2O2
Molmasse: 281.13

Namen und Synonyme

14868-03-21,1-Dichloro-2,2-bis(4-hydroxyphenyl)ethyleneBis(4-hydroxyphenyl)-2,2-dichloroethylenePhenol, 4,4'-(dichloroethenylidene)bis-Bisphenol C 21,1-Bis(4-hydroxyphenyl)-2,2-dichloroethylene4,4'-(Dichlorovinylidene)diphenolDTXSID5022485U4668GRX7TEINECS 238-940-0DTXCID4024851,1-dichloro-2,2-bis(4-hydroxyphenyl)ethene

Weitere Namen anzeigen

BISPHENOL CBisphenol DBisphenol C2Bisphenol C2 SolutionBisphenol C-dichlorideBisphenol - C (Chlorine)Bisphenol D in acetonitrileBisphenol C ISO 9001：2015 REACH

Phenol, 4,4'-(2,2-dichloroethenylidene)bis-4,4'-(Dichloroethenylidene)bis[phenol]BIS(4-HYDROXYPHENYL)DICHLOROETHYLENE4,4'-(2,2-DICHLOROETHENYLIDENE)BIS-PHENOL1,1-DICHLORO-2,2-BIS(P-HYDROXYPHENYL)ETHYLENE2,2-DICHLORO-1,1-BIS(4-HYDROXYPHENYL)ETHYLENE4,4'-(Dichloroethenylidene)bis(phenol)RefChem:409695

Datenbank-Bezeichner

CAS: 14868-03-2
PubChem CID: 84677
DTXSID: DTXSID5022485
ChEMBL: CHEMBL592305
ChEBI: CHEBI:34030
UNII: U4668GRX7T
EC Number: 238-940-0
Nikkaji: J227.221K

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 5
Polarare Oberfläche (TPSA): 40,5 Å²
H-Brücken-Donoren: 2
H-Brücken-Akzeptoren: 2
Frei drehbare Bindungen: 2
Schwere Atome: 18
Formalladung: 0
Komplexität: 273

Experimentelle und physikochemische Eigenschaften

Collision Cross Section165.3 Å² [M-H]-

Physikochemische Eigenschaften

Schmelzpunkt: 213 · 213-217 °C(lit.)
Siedepunkt: 405 · 405.0±40.0 °C(Predicted)
Dichte: 1.407 · 1.407±0.06 g/cm3(Predicted)
storage temp.: Hygroscopic, Refrigerator, under inert atmosphere
Löslichkeit: DMSO (Slightly), Ethyl Acetate (Slightly)
Aggregatzustand: Solid
pka: 9.86 · 9.86±0.15(Predicted)
Farbe: White to Off-White
BRN: 2052978 · 2052978
Stabilität: Hygroscopic
CAS Datenbank: 14868 · 14868-03-2(CAS DataBase Reference)
EPA chemische Informationen: 4 · Phenol, 4,4'-(dichloroethenylidene)bis- (14868-03-2)

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 5 Einträge

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]；H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]；H335 (98%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract 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)

Aggregated GHS information provided per 50 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.