Einecs 262-498-8

Base Information

• Chemical Name: Einecs 262-498-8
• CAS No.: 60864-69-9
• Molecular Formula: C23H26 Br F O6
• Molecular Weight: 497.3513432
• European Community (EC) Number: 262-498-8
• DSSTox Substance ID: DTXSID50976342
• Mol file: 60864-69-9.mol

Synonyms:EINECS 262-498-8;60864-69-9;2-Bromo-9beta,11beta-epoxy-6beta-fluoro-17,21-dihydroxypregna-1,4-diene-3,20-dione 21-acetate;DTXSID50976342;2-Bromo-6-fluoro-17-hydroxy-3,20-dioxo-9,11-epoxypregna-1,4-dien-21-yl acetate

Chemical Property of Einecs 262-498-8

Chemical Property:

• XLogP3: 2.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 4
• Exact Mass: 496.08968
• Heavy Atom Count: 31
• Complexity: 975

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: CC(=O)OCC(=O)C1(CCC2C1(CC3C4(C2CC(C5=CC(=O)C(=CC54C)Br)F)O3)C)O
• Isomeric SMILES: CC(=O)OCC(=O)[C@]1(CC[C@@H]2[C@@]1(CC3C4([C@H]2C[C@H](C5=CC(=O)C(=C[C@@]54C)Br)F)O3)C)O

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