Grundinformationen
- Standard-SMILES
O=Cc1c2ccccc2c(Cl)c2ccccc12- InChIKey
SHYBXXMECBHHFH-UHFFFAOYSA-N- Summenformel
- C15H9ClO
- Durchschnittliche Molmasse
- 240,68 g/mol
- Monoisotopische Masse
- 240,03419259
Namen und Bezeichner
- Bevorzugter Name
- 10-Chloro-9-anthraldehyde
- IUPAC
- 10-chloroanthracene-9-carbaldehyde
- Lokaler Name
- 10-Chloranthracen-9-carbaldehyd
- Englischer Name
- 10-CHLORO-9-ANTHRALDEHYDE
- Summenformel
- C15H9ClO
- Molmasse
- 240.68
Namen und Synonyme
10-Chloro-9-anthraldehyde10-Chloroanthracene-9-carbaldehyde10527-16-9DTXSID804920210-Chloro-9-anthracenecarbaldehyde9-chloro-10-formylanthracene9-Anthraldehyde, 10-chloro-7RQ1N54G12EINECS 234-086-8DTXCID302847310Chloro9anthraldehydeRefChem:437004
Weitere Namen anzeigen
10-CHLORO-9-ANTHRALDEHYDE 97%10-Chloro-9-anthraldehyde,97%9-Anthracenecarboxaldehyde,10-chloro-N,N-diethyl-3-(2-phenoxyphenoxy)-1-propanamine hydrochloride
234-086-810-chloroanthracene-9-carboxaldehydeMFCD00001255UNII-7RQ1N54G12SCHEMBL1616239CHEMBL318765410-Chloro-9-anthraldehyde, 97%10 -chloroanthracene-9-carbaldehyde
Datenbank-Bezeichner
- CAS
10527-16-9- PubChem CID
- 82703
- DTXSID
DTXSID8049202- ChEMBL
CHEMBL3187654- UNII
- 7RQ1N54G12
- EC Number
- 234-086-8
- Nikkaji
- J212.460B
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 4,5
- Polarare Oberfläche (TPSA)
- 17,1 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 1
- Frei drehbare Bindungen
- 1
- Schwere Atome
- 17
- Formalladung
- 0
- Komplexität
- 267
Experimentelle und physikochemische Eigenschaften
PolymersOther Classes -> Polycyclic Aromatic Hydrocarbons
Physical DescriptionSolid; [Aldrich MSDS]
Physikochemische Eigenschaften
- Schmelzpunkt
- 215 · 215-218 °C (lit.)
- Siedepunkt
- 435.9 · 435.9±18.0 °C(Predicted)
- Dichte
- 1.327 · 1.327±0.06 g/cm3(Predicted)
- Aggregatzustand
- solid
- InChI
- 1S/C15H9ClO/c16-15-12-7-3-1-5-10(12)14(9-17)11-6-2-4-8-13(11)15/h1-9H
- InChIKey
- SHYBXXMECBHHFH-UHFFFAOYSA-N
- SMILES
- [H]C(=O)c1c2ccccc2c(Cl)c3ccccc13
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, 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.
Gefahrenhinweise
Hazards SummaryMay cause irritation; [Aldrich MSDS] See POLYCYCLIC AROMATIC HYDROCARBONS.
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Sicherheitsdaten
- wgk
- 3
- hs_code
- 2913000090
- Speicherklasse
- 11 - Combustible Solids
Chemie und Industrie
Anwendungen
Verwenden10-Chloro-9-anthraldehyde was used in the preparation of trans-1-(10-methyl-9-anthryl)-2-(4-pyridyl)-ethene, 1-(10-chloro-9-anthryl)-2-(4-pyridyl)-ethene, 1-(10-methyl-9-anthryl)-2-(4-(N-methyl)-pyridinium)ethene iodide and 1-(10-chloro-9-anthryl)-2-(4-(N-methyl)pyridinium)ethene iodide.
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