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Lup-20(29)-Ene-1,3-Dione
[CAS# 6610-60-2]

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Identification
Name Lup-20(29)-Ene-1,3-Dione
Molecular Structure CAS#: 6610-60-2, Lup-20(29)-Ene-1,3-Dione
Molecular Formula C18H13ClN2O3S
Molecular Weight 372.83
CAS Registry Number 6610-60-2
SMILES C1=CC2=C(C=C1)N=C(N(C2=O)C3=C(C=CC=C3)Cl)SC4CCOC4=O
InChI 1S/C18H13ClN2O3S/c19-12-6-2-4-8-14(12)21-16(22)11-5-1-3-7-13(11)20-18(21)25-15-9-10-24-17(15)23/h1-8,15H,9-10H2
InChIKey FCXKBMUNDHKOFN-UHFFFAOYSA-N
Properties
Density 1.5g/cm3 (Cal.)
Boiling point 605.803°C at 760 mmHg (Cal.)
Flash point 320.178°C (Cal.)
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