CAS 2175-90-8 6,6'-Diphenylfulvene (HCID 101236)

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Grundinformationen

CAS: 2175-90-8
Standard-SMILES: C1=CC(=C(c2ccccc2)c2ccccc2)C=C1
InChIKey: BULLHRADHZGONG-UHFFFAOYSA-N
Summenformel: C18H14
Durchschnittliche Molmasse: 230,3 g/mol
Monoisotopische Masse: 230,10955045

Namen und Bezeichner

Bevorzugter Name: 6,6'-Diphenylfulvene
IUPAC: [cyclopenta-2,4-dien-1-ylidene(phenyl)methyl]benzene
Lokaler Name: 6,6'-Diphenylfulven
Englischer Name: DIPHENYLFULVENE
Summenformel: C18H14
Molmasse: 230.3

Namen und Synonyme

6,6-DiphenylfulveneDiphenylfulvene6,6'-DiphenylfulveneDiphenylmethylidene cyclopentadiene6,6-DiphenylpentafulveneBenzene, 1,1'-(2,4-cyclopentadien-1-ylidenemethylene)bis-I8CJ7P33G3Fulvene, 6,6-diphenylNSC 402188NSC-402188UNII-I8CJ7P33G3DTXSID50176148

Weitere Namen anzeigen

Diphenyl rich eneDiphenylfulvene 98%6,6-DIOHENYLFULVENE6,6'-Diphenylfulven6,6-Diphenylfulvene>Diphenylmethylidene cyclopentadiene

FULVENE, 6,6-DIPHENYL-EINECS 218-533-4(2-(CYCLOPENTA-2,4-DIENYLIDENE)PROPANE-1,3-DIYL)DIBENZENE1,1'-(2,4-CYCLOPENTADIEN-1-YLIDENEMETHYLENE)BIS(BENZENE)[2-(Cyclopenta-2,4-dienylidene)propane-1,3-diyl]dibenzeneRefChem:103744DTXCID00986395(Diphenylmethylene)1,3cyclopentadiene

Datenbank-Bezeichner

CAS: 2175-90-8
PubChem CID: 101236
DTXSID: DTXSID50176148
UNII: I8CJ7P33G3
EC Number: 218-533-4

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 5,4
Polarare Oberfläche (TPSA): 0 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 0
Frei drehbare Bindungen: 2
Schwere Atome: 18
Formalladung: 0
Komplexität: 323

Experimentelle und physikochemische Eigenschaften

Physical DescriptionSolid; [Sigma-Aldrich MSDS]

Physikochemische Eigenschaften

Schmelzpunkt: 81.5 · 81.5-83 °C (lit.)
Siedepunkt: 307.3 °C · 307.3°C (rough estimate)
Dichte: 1.0829 · 1.0829 (estimate)
Dampfdruck: 0.033 · 0.033-0.084Pa at 25℃
Brechungsindex: 1.55 · 1.5500 (estimate)
storage temp.: Refrigerator
Aggregatzustand: Solid
Farbe: Light yellow to Brown
InChI: InChI=1S/C18H14/c1-3-9-15(10-4-1)18(17-13-7-8-14-17)16-11-5-2-6-12-16/h1-14H
InChIKey: BULLHRADHZGONG-UHFFFAOYSA-N
SMILES: C(/C1=CC=CC=C1)(\C1=CC=CC=C1)=C1\C=CC=C\1
LogP: 3.43 · 3.43

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 3 Einträge

This chemical does not meet GHS hazard criteria for 100% (3 of 3) of all reports.

Not Classified；Reported as not meeting GHS hazard criteria by 3 of 3 companies. For more detailed information, please visit ECHA C&L website.

Aggregated GHS information provided per 3 reports by companies from 1 notifications to the ECHA C&L Inventory.；Reported as not meeting GHS hazard criteria per 3 of 3 reports by companies.；There are 0 notifications provided by 0 of 3 reports by companies with hazard statement code(s).；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.