896795-60-1

Name CM037
CAS 896795-60-1
Molecular Formula C21H25N3O3S2
Molecular Weight 431.57
MOL File 896795-60-1.mol
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Chemical Properties

Melting point  >99°C (dec.)
Boiling point  602.5±65.0 °C(Predicted)
density  1.38±0.1 g/cm3(Predicted)
storage temp.  -20°C Freezer, Under inert atmosphere
solubility  DMSO (Slightly), Methanol (Slightly)
form  Solid
pka 10.11±0.20(Predicted)
color  Off-White to Light Beige
InChI 1S/C21H25N3O3S2/c1-2-27-17(25)14-28-21-22-18-15-8-3-4-9-16(15)29-19(18)20(26)24(21)13-7-12-23-10-5-6-11-23/h3-4,8-9H,2,5-7,10-14H2,1H3
InChIKey SKDRHRAYBYQVNU-UHFFFAOYSA-N
SMILES O=C1N(CCCN2CCCC2)C(SCC(OCC)=O)=NC3=C1SC4=CC=CC=C43

Safety Data

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H302-H315-H319
Precautionary statements  P264-P270-P280-P301+P312-P330-P302+P352-P321-P305+P351+P338-P332+P313-P362+P364-P337+P313-P501
WGK Germany  WGK 3
Storage Class 11 - Combustible Solids

Hazard Information

Spectrum Detail

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