(3R,4R)-3-bromo-1,2,3,4-tetrahydrophenanthren-4-ol

Base Information

• Chemical Name: (3R,4R)-3-bromo-1,2,3,4-tetrahydrophenanthren-4-ol
• CAS No.: 56179-85-2
• Molecular Formula: C₁₄H₁₃BrO
• Molecular Weight: 277.161
• DSSTox Substance ID: DTXSID60575845
• Wikidata: Q82465270

Synonyms:(3R,4R)-3-bromo-1,2,3,4-tetrahydrophenanthren-4-ol;56179-85-2;DTXSID60575845

Chemical Property of (3R,4R)-3-bromo-1,2,3,4-tetrahydrophenanthren-4-ol

Chemical Property:

• XLogP3: 3.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 276.01498
• Heavy Atom Count: 16
• Complexity: 255

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC2=C(C(C1Br)O)C3=CC=CC=C3C=C2
• Isomeric SMILES: C1CC2=C([C@H]([C@@H]1Br)O)C3=CC=CC=C3C=C2

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