Friedeline
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Friedeline

CAS 559-74-0
Structure
Synonyms 3-Friedelanone
IUPAC Name (4R,4aS,6aS,6aS,6bR,8aR,12aR,14aS,14bS)-4,4a,6a,6b,8a,11,11,14a-octamethyl-2,4,5,6,6a,7,8,9,10,12,12a,13,14,14b-tetradecahydro-1H-picen-3-one
Molecular Weight 426.72
Molecular Formula C30H50O
Canonical SMILES C[C@H]1C(=O)CC[C@@H]2[C@@]1(CC[C@H]3[C@]2(CC[C@@]4([C@@]3(CC[C@@]5([C@H]4CC(CC5)(C)C)C)C)C)C)C
InChI InChI=1S/C30H50O/c1-20-21(31)9-10-22-27(20,5)12-11-23-28(22,6)16-18-30(8)24-19-25(2,3)13-14-26(24,4)15-17-29(23,30)7/h20,22-24H,9-19H2,1-8H3/t20-,22+,23-,24+,26+,27+,28-,29+,30-/m0/s1
InChI Key OFMXGFHWLZPCFL-SVRPQWSVSA-N
Boiling Point 477.2±13.0 °C
Melting Point 262-265 °C (lit.)
Purity 98%
Density 0.963±0.06 g/ml
Appearance Powder

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