1531-77-7

Name Dibenzo[b,e]thiepin-11(6H)-one
CAS 1531-77-7
EINECS(EC#) 216-241-1
Molecular Formula C14H10OS
MDL Number MFCD02093738
Molecular Weight 226.29
MOL File 1531-77-7.mol
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Chemical Properties

Appearance off-white crystalline powder
Melting point  86-88 °C(lit.)
Boiling point  175-180°C 1mm
density  1.1989 (rough estimate)
refractive index  1.5700 (estimate)
Fp  175-180°C/1mm
storage temp.  Keep in dark place,Sealed in dry,Room Temperature
form  solid
InChI InChI=1S/C14H10OS/c15-14-11-6-2-1-5-10(11)9-16-13-8-4-3-7-12(13)14/h1-8H,9H2
InChIKey JGJDEWXZEIHBNW-UHFFFAOYSA-N
SMILES S1CC2=CC=CC=C2C(=O)C2=CC=CC=C12
CAS DataBase Reference 1531-77-7(CAS DataBase Reference)
NIST Chemistry Reference Dibenzo[b,e]thiepin-11(6H)-one(1531-77-7)

Safety Data

Hazard Codes  Xi
Risk Statements 
R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Statements 
S37/39:Wear suitable gloves and eye/face protection .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
WGK Germany  3
HS Code  2930.90.2900
Storage Class 11 - Combustible Solids

Hazard Information

Material Safety Data Sheet(MSDS)

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