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205687-01-0

Name CAPSIATE
CAS 205687-01-0
Molecular Formula C18H26O4
MDL Number MFCD28401009
Molecular Weight 306.4
MOL File 205687-01-0.mol
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Chemical Properties

Boiling point  421.3±40.0 °C(Predicted)
density  1.053
storage temp.  -20°C
solubility  DMF: 30 mg/ml,DMSO: 30 mg/ml,Ethanol: 30 mg/ml
form  A liquid
pka 9.51±0.20(Predicted)
color  Colorless to light yellow
InChI InChI=1S/C18H26O4/c1-14(2)8-6-4-5-7-9-18(20)22-13-15-10-11-16(19)17(12-15)21-3/h6,8,10-12,14,19H,4-5,7,9,13H2,1-3H3/b8-6+
InChIKey ZICNYIDDNJYKCP-SOFGYWHQSA-N
SMILES C(OCC1=CC=C(O)C(OC)=C1)(=O)CCCC/C=C/C(C)C
LogP 4.515 (est)

Safety Data

Symbol(GHS) 
GHS06
Signal word  Danger
Hazard statements  H300-H315-H319-H335
Precautionary statements  P501-P261-P270-P271-P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313-P301+P310+P330-P304+P340+P312-P403+P233-P405

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