5957-80-2

Name CARNOSOL
CAS 5957-80-2
Molecular Formula C20H26O4
MDL Number MFCD02752467
Molecular Weight 330.42
MOL File 5957-80-2.mol

Chemical Properties

Melting point  240~242℃
Boiling point  524.8±50.0 °C(Predicted)
density  1.26±0.1 g/cm3(Predicted)
storage temp.  Sealed in dry,Store in freezer, under -20°C
solubility  DMSO:66.0(Max Conc. mg/mL);199.74(Max Conc. mM)
form  neat
pka 8.91±0.40(Predicted)
color  White
biological source Rosemarinus officinalis L. leaves
Major Application food and beverages
InChI InChI=1S/C20H26O4/c1-10(2)11-8-12-13-9-14-19(3,4)6-5-7-20(14,18(23)24-13)15(12)17(22)16(11)21/h8,10,13-14,21-22H,5-7,9H2,1-4H3/t13-,14-,20+/m0/s1
InChIKey XUSYGBPHQBWGAD-PJSUUKDQSA-N
SMILES C1(C)(C)[C@@]2([H])[C@]3(C(=O)O[C@@]([H])(C2)C2=C3C(O)=C(O)C(C(C)C)=C2)CCC1
LogP 2.832 (est)

Safety Data

Safety Statements 
WGK Germany  3
HS Code  29322090
Storage Class 11 - Combustible Solids
Hazard Classifications Skin Sens. 1
Hazardous Substances Data 5957-80-2(Hazardous Substances Data)

Hazard Information

Questions And Answer

Spectrum Detail

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