(2R,7R)-2-[(1R)-1-bromopropyl]-7-[(Z,1R)-1-chlorohex-3-en-5-ynyl]-2,3,6,7-tetrahydrooxepine

Base Information

• Chemical Name: (2R,7R)-2-[(1R)-1-bromopropyl]-7-[(Z,1R)-1-chlorohex-3-en-5-ynyl]-2,3,6,7-tetrahydrooxepine
• CAS No.: 143120-38-1
• Molecular Formula: C15H20 Br Cl O
• DSSTox Substance ID: DTXSID401118496
• Nikkaji Number: J1.494.092H
• Wikidata: Q105370040
• Mol file: 143120-38-1.mol

Synonyms:DTXSID401118496;143120-38-1;(2R,7R)-2-[(1R)-1-Bromopropyl]-7-[(1R,3Z)-1-chloro-3-hexen-5-yn-1-yl]-2,3,6,7-tetrahydrooxepin

Chemical Property of (2R,7R)-2-[(1R)-1-bromopropyl]-7-[(Z,1R)-1-chlorohex-3-en-5-ynyl]-2,3,6,7-tetrahydrooxepine

Chemical Property:

• XLogP3: 5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 5
• Exact Mass: 330.03861
• Heavy Atom Count: 18
• Complexity: 342

Purity/Quality:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(C1CC=CCC(O1)C(CC=CC#C)Cl)Br
• Isomeric SMILES: CC[C@H]([C@H]1CC=CC[C@@H](O1)[C@@H](C/C=C\C#C)Cl)Br

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