4504-87-4

Name Dibenz[b,e]oxepin-11(6H)-one
CAS 4504-87-4
EINECS(EC#) 224-820-5
Molecular Formula C14H10O2
MDL Number MFCD00963963
Molecular Weight 210.23
MOL File 4504-87-4.mol
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Chemical Properties

Melting point  68-70?C
Boiling point  386.8±32.0 °C(Predicted)
density  1.226±0.06 g/cm3(Predicted)
storage temp.  Sealed in dry,Room Temperature
solubility  Chloroform (Slightly), Ethyl Acetate (Slightly) , Methanol (Slightly)
form  Solid
color  Off-White to Light Yellow
Major Application pharmaceutical (small molecule)
InChI InChI=1S/C14H10O2/c15-14-11-6-2-1-5-10(11)9-16-13-8-4-3-7-12(13)14/h1-8H,9H2
InChIKey YUSHFLBKQQILNV-UHFFFAOYSA-N
SMILES O1CC2=CC=CC=C2C(=O)C2=CC=CC=C12
CAS DataBase Reference 4504-87-4(CAS DataBase Reference)
NIST Chemistry Reference Dibenz[b,e]oxepin-11(6H)-one(4504-87-4)

Safety Data

Symbol(GHS)  Skull and Crossbones (GHS06)
GHS06
Signal word  Danger
Hazard statements  H301
Precautionary statements  P264-P270-P301+P310-P405-P501
WGK Germany  WGK 3
REACH Registrations Active
HS Code  2932996560
Storage Class 6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
Hazard Classifications Acute Tox. 3 Oral

Hazard Information

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