2-Bromo-7H-benz(de)anthracen-7-one
[CAS# 67314-15-2]

Identification

• Name: 2-Bromo-7H-benz(de)anthracen-7-one
• Synonyms: (3S,8S,9S,10R,13R,14S,17R)-10,13-Dimethyl-17-[(1R,4R)-1-Methyl-4-[(1R,2R)-2-Methylcyclopropyl]Pentyl]-2,3,4,7,8,9,11,12,14,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-3-Ol; 26,27-Dinorcholest-5-En-3-Ol, 24-(2-Methylcyclopropyl)-, (3Beta,24R(1R,2R))-; 26,27-Dinorcholest-5-En-3-Ol, 24-(2-Methylcyclopropyl)-, (3Beta,24R(1S,2R))-
• Molecular Formula: C₂₉H₄₈O
• Molecular Weight: 412.70
• CAS Registry Number: 67314-15-2
• SMILES: [C@]24([C@H]([C@@H]1CC=C3[C@@]([C@H]1CC2)(CC[C@H](O)C3)C)CC[C@@H]4[C@@H](CC[C@H]([C@@H]5C[C@H]5C)C)C)C
• InChI: 1S/C29H48O/c1-18(24-16-20(24)3)6-7-19(2)25-10-11-26-23-9-8-21-17-22(30)12-14-28(21,4)27(23)13-15-29(25,26)5/h8,18-20,22-27,30H,6-7,9-17H2,1-5H3/t18-,19-,20-,22+,23+,24+,25-,26+,27+,28+,29-/m1/s1
• InChIKey: AOOVLQXWRHMRMX-BFPAFGTMSA-N

Properties

• Density: 1.016g/cm³ (Cal.)
• Boiling point: 505.994°C at 760 mmHg (Cal.)
• Flash point: 219.65°C (Cal.)