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Ocobullenone
[CAS# 149990-50-1]

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CAS#: 149990-50-1
Product: Ocobullenone
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Identification
Name Ocobullenone
Molecular Structure CAS#: 149990-50-1, Ocobullenone
Molecular Formula C21H22O6
Molecular Weight 370.40
CAS Registry Number 149990-50-1
SMILES [C@@]13([C@H]([C@@H](C)[C@@]2(C1)OCOC2=CC3=O)C5=CC(=C4OCOC4=C5)OC)CC=C
InChI 1S/C21H22O6/c1-4-5-20-9-21(17(8-16(20)22)25-11-27-21)12(2)18(20)13-6-14(23-3)19-15(7-13)24-10-26-19/h4,6-8,12,18H,1,5,9-11H2,2-3H3/t12-,18-,20+,21-/m1/s1
InChIKey VMBFNOIPGQFDTB-XFHMVGKKSA-N
Properties
Density 1.338g/cm3 (Cal.)
Boiling point 510.191°C at 760 mmHg (Cal.)
Flash point 224.021°C (Cal.)
Market Analysis Reports
List of Reports Available for Ocobullenone
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