9-Phenanthrenemethanol, 6-bromo-alpha-((diheptylamino)methyl)-

Base Information

• Chemical Name: 9-Phenanthrenemethanol, 6-bromo-alpha-((diheptylamino)methyl)-
• CAS No.: 27022-39-5
• Molecular Formula: C30H42 Br N O
• Molecular Weight: 512.56458
• UNII: 1IP26U1AXI
• DSSTox Substance ID: DTXSID00865333
• Wikidata: Q27252470
• ChEMBL ID: CHEMBL1198271

Synonyms:WR 33063;WR 33063, (+)-isomer;WR 33063, (+-)-isomer;WR 33063, (-)-isomer;WR 33063, citrate;WR 33063, hydrochloride, (+)-isomer;WR 33063, hydrochloride, (+-)-isomer;WR 33063, hydrochloride, (-)-isomer;WR 33063, hydrochoride;WR 33063, tartrate;WR-33,063;WR-33063

Chemical Property of 9-Phenanthrenemethanol, 6-bromo-alpha-((diheptylamino)methyl)-

Chemical Property:

• PSA: 23.47000
• LogP: 9.03170
• XLogP3: 10.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 15
• Exact Mass: 511.24498
• Heavy Atom Count: 33
• Complexity: 500

Purity/Quality:

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: CCCCCCCN(CCCCCCC)CC(C1=CC2=CC=CC=C2C3=C1C=CC(=C3)Br)O

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