Identification Chemical Properties Safety Data Hazard Information Supplier Related Products

470-17-7

Name Isoalantolactone
CAS 470-17-7
Molecular Formula C15H20O2
MDL Number MFCD00056777
Molecular Weight 232.32
MOL File 470-17-7.mol

Chemical Properties

Melting point  115℃
Boiling point  364.9±42.0 °C(Predicted)
density  1.07±0.1 g/cm3(Predicted)
storage temp.  Sealed in dry,2-8°C
solubility  Soluble in DMSO (up to 50 mg/ml) or ethanol (30 mg/ml)
form  solid
color  White
Stability: Stable for 1 year from date of purchase as supplied. Solutions in DMSO or ethanol may be stored at -20°C for up to 1 month.
InChI InChI=1S/C15H20O2/c1-9-5-4-6-15(3)8-13-11(7-12(9)15)10(2)14(16)17-13/h11-13H,1-2,4-8H2,3H3/t11-,12+,13-,15-/m1/s1
InChIKey CVUANYCQTOGILD-QVHKTLOISA-N
SMILES O1C(=O)C(=C)[C@@]2([H])C[C@]3([H])[C@@](C)(C[C@@]12[H])CCCC3=C
LogP 3.420
CAS DataBase Reference 470-17-7(CAS DataBase Reference)
NIST Chemistry Reference Naphtho(2,3-b)furan-2(3h)-one, decahydro-8a-methyl-3,5-bis(methylene)-, (3ar-(3a«alpha»,4a«alpha»,8a«beta»,9a«alpha»))-(470-17-7)

Safety Data

Hazard Codes  Xn
Risk Statements 
R40:Limited evidence of a carcinogenic effect.
Safety Statements 
S22:Do not breathe dust .
S36:Wear suitable protective clothing .
HS Code  29322090

Hazard Information

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