6-Chlorochromone
Grundinformationen
- CAS
33533-99-2- Standard-SMILES
O=c1ccoc2ccc(Cl)cc12- InChIKey
VFZQATFTQAZCMO-UHFFFAOYSA-N- Summenformel
- C9H5ClO2
- Durchschnittliche Molmasse
- 180,59 g/mol
- Monoisotopische Masse
- 179,99780708
Namen und Bezeichner
- Bevorzugter Name
- 6-Chlorochromone
- IUPAC
- 6-chlorochromen-4-one
- Englischer Name
- 6-Chlorochromone
- Summenformel
- C9H5ClO2
- Molmasse
- 180.59
Namen und Synonyme
6-Chlorochromone33533-99-26-chlorochromen-4-one6-Chloro-chromen-4-oneDTXSID203451226-Chloro-1-benzopyran-4(4H)-oneRefChem:104431DTXCID30296196801-231-7VFZQATFTQAZCMO-UHFFFAOYSA-N6-Chloro-4H-chromen-4-oneMFCD00191904
Weitere Namen anzeigen
6-Chlorochromone >6-CHLOROCHROMONE 97%6-chloro-1-benzopyran-4-one6-CHLORO-1-BENZOPYRAN-4(4 H)-ONE4H-1-Benzopyran-4-one, 6-chloro-JRH-00603, 6-Chloro-4H-chromen-4-one, 97%6-Chlorochromone (6-Chloro-4H-chromene-4-one)
6-Chloro-4H-1-benzopyran-4-oneSCHEMBL206945SCHEMBL365385orb30314286-Chloro-4H-chromen-4-one #HMS1661D21SBB081178AKOS000275966
Datenbank-Bezeichner
- CAS
33533-99-2- PubChem CID
- 601989
- DTXSID
DTXSID20345122- EC Number
- 801-231-7
- Nikkaji
- J1.114.895F
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,4
- Polarare Oberfläche (TPSA)
- 26,3 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 0
- Schwere Atome
- 12
- Formalladung
- 0
- Komplexität
- 225
Physikochemische Eigenschaften
- Schmelzpunkt
- 136 · 136-138 °C(lit.)
- Siedepunkt
- 290.9 · 290.9±40.0 °C(Predicted)
- Dichte
- 1.399 · 1.399±0.06 g/cm3(Predicted)
- storage temp.
- Sealed in dry,Room Temperature
- Aggregatzustand
- powder to crystal
- Farbe
- White to Orange to Green
- CAS Datenbank
- 33533 · 33533-99-2(CAS DataBase Reference)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/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 3 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Sicherheitsdaten
- wgk
- 3
- hs_code
- 2932990090
- risk_code
- 20/21/22-36/37/38
- hazard_code
- Xn
- safety_code
- 26-36
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