Grundinformationen
- Standard-SMILES
CC1(C)c2ccccc2Oc2ccccc21- InChIKey
MTVNAPYHLASOSX-UHFFFAOYSA-N- Summenformel
- C15H14O
- Durchschnittliche Molmasse
- 210,27 g/mol
- Monoisotopische Masse
- 210,10446507
Namen und Bezeichner
- Bevorzugter Name
- 9,9-Dimethylxanthene
- IUPAC
- 9,9-dimethylxanthene
- Englischer Name
- 9,9-DIMETHYL-9H-XANTHENE
- Summenformel
- C15H14O
- Molmasse
- 210.27
Namen und Synonyme
9,9-Dimethylxanthene9,9-Dimethyl-9H-xanthene19814-75-6DTXSID00345781RefChem:548989DTXCID90296854803-050-99H-Xanthene, 9,9-dimethyl-MFCD001344349,9-Dimethylxantene9,9-Dimethylxanthene, 96%SB66879
Weitere Namen anzeigen
CL159LABOTEST-BB LT001601339,9-Dimethylxanthene>9,9-DIMETHYL-9H-XANTHENE9,9-Dimethylxanthene 96%9,9-Dimethylxanthene, 98+%9,9-Dimethylxanthene, 97.5%9,9-Dimethyl-9H-xanthene ,97%
EN300-399509,9-Dimethyl-9H-xanthene (purified by sublimation)Z406356592BCP14981Xanthene, 9,9-dimethyl-A813961SCHEMBL470099,9-Dimethyl-9H-xanthene #
Datenbank-Bezeichner
- CAS
19814-75-6- PubChem CID
- 606997
- DTXSID
DTXSID00345781- EC Number
- 803-050-9
- Nikkaji
- J784.399B
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 4,3
- Polarare Oberfläche (TPSA)
- 9,2 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 1
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 16
- Formalladung
- 0
- Komplexität
- 234
Physikochemische Eigenschaften
- Schmelzpunkt
- 35 · 35-38 °C (lit.)
- Siedepunkt
- 114 · 114-115 °C/0.6 mmHg (lit.)
- Dichte
- 1.0232 · 1.0232 (rough estimate)
- Brechungsindex
- 1.5725 · 1.5725 (estimate)
- Flammpunkt
- 230 °F · >230 °F
- storage temp.
- Sealed in dry,Room Temperature
- Aggregatzustand
- powder to lump to clear liquid
- Farbe
- White or Colorless to Yellow to Green
- Wasserlöslichkeit
- Insoluble in water.
- InChI
- InChI=1S/C15H14O/c1-15(2)11-7-3-5-9-13(11)16-14-10-6-4-8-12(14)15/h3-10H,1-2H3
- InChIKey
- MTVNAPYHLASOSX-UHFFFAOYSA-N
- SMILES
- C1(C)(C)C2=C(C=CC=C2)OC2=C1C=CC=C2
- CAS Datenbank
- 19814 · 19814-75-6
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 100% (39 of 39) of all reports.
Not Classified
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory.
Gefahrenhinweise
Hazard Classes and CategoriesNot Classified
Sicherheitsdaten
- wgk
- 3
- hs_code
- 29329990
- risk_code
- 43
- hazard_code
- Xi
- safety_code
- 36/37-24/25
- Speicherklasse
- 11 - Combustible Solids
Chemie und Industrie
Anwendungen
Verwenden9,9-Dimethylxanthene is suitable for use in the preparation of 9,9-dimethylxanthene-4,5-dicarboxylic acid. It may be used in the preparation of 9,9-dimethyl-4,5-bis(diphenylphosphino)xanthene. It may be used in the preparation of 4,6-bis(dimesitylboryl)dibenzofuran.
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