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3159-07-7

Name 10,11-Dihydro-11-oxodibenzo[b,f][1,4]thiazepine
CAS 3159-07-7
EINECS(EC#) 1592732-453-0
Molecular Formula C13H9NOS
MDL Number MFCD00901197
Molecular Weight 227.28
MOL File 3159-07-7.mol
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Chemical Properties

Appearance Off-White Powder
Melting point  265 °C
Boiling point  309.2±12.0 °C(Predicted)
density  1.292±0.06 g/cm3(Predicted)
storage temp.  Refrigerator
solubility  DMSO (Slightly, Heated)
form  Solid
pka 12.40±0.20(Predicted)
color  White to Off-White
InChI InChI=1S/C13H9NOS/c15-13-9-5-1-3-7-11(9)16-12-8-4-2-6-10(12)14-13/h1-8H,(H,14,15)
InChIKey RTERDTBXBYNZIS-UHFFFAOYSA-N
SMILES S1C2=CC=CC=C2C(=O)NC2=CC=CC=C12
CAS DataBase Reference 3159-07-7(CAS DataBase Reference)

Safety Data

Risk Statements 
R36/37/38:Irritating to eyes, respiratory system and skin .
Safety Statements 
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
HS Code  2934990002

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