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Cyclooctene, 5,6-dibromo- structure

Cyclooctene, 5,6-dibromo-
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1. Names and Identifiers
1.1 Name
Cyclooctene, 5,6-dibromo-
1.2 Synonyms
5,6-dibromocyclooctene; AC1L6QEQ; CTK1A7818; NSC 167076;
1.3 CAS No.
24165-06-8
1.4 CID
5383388
1.5 Molecular Formula
C8H12Br2
1.6 Inchi
InChI=1S/C8H12Br2/c9-7-5-3-1-2-4-6-8(7)10/h1-2,7-8H,3-6H2/b2-1-
1.7 InChkey
NNFZIBYWUOSNJE-UPHRSURJSA-N
1.8 Canonical Smiles
C1CC(C(CCC=C1)Br)Br
1.9 Isomers Smiles
C/1CC(C(CC/C=C1)Br)Br
2. MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

no data available

2.2 GHS label elements, including precautionary statements

Pictogram(s) no data available
Signal word

no data available

Hazard statement(s)

no data available
Precautionary statement(s)
Prevention

no data available

Response

no data available

Storage

no data available

Disposal

no data available

2.3 Other hazards which do not result in classification

no data available

View all
3. Synthesis Route
24165-06-8Total: 2 Synthesis Route
 
1552-12-1
1552-12-1 16 Suppliers
 
24165-06-8
24165-06-8 1 Suppliers
 
1552-12-1
1552-12-1 16 Suppliers
 
3194-57-8
3194-57-8 6 Suppliers
 
24165-06-8
24165-06-8 1 Suppliers
4. Precursor and Product
precursor:
1552-12-1
1552-12-1
5. Computed Properties
  • Molecular Weight：267.992g/mol
  • Molecular Formula：C8H12Br2
  • Compound Is Canonicalized：True
  • Exact Mass：3.7
  • XLogP3-AA：267.92853
  • Monoisotopic Mass：265.93058
  • Complexity：106
  • Rotatable Bond Count：0
  • Hydrogen Bond Donor Count：0
  • Hydrogen Bond Acceptor Count：0
  • Topological Polar Surface Area：0
  • Heavy Atom Count：：10
  • Defined Atom Stereocenter Count：0
  • Undefined Atom Stereocenter Count：2
  • Defined Bond Stereocenter Count：1
  • Undefined Bond Stereocenter Count：0
  • Isotope Atom Count：0
  • Covalently-Bonded Unit Count：1
  • CACTVS Substructure Key Fingerprint：AAADccBwAAAAGAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAQAAAAAAAAGABAAAAByACAAAAAAAAAAACAACBCAAAAAAAgAAAICAAAACgAAAIAAQAAAAAAgAAIAAMAgIAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA==
6. Toltal 1 Suppliers View more
Cyclooctene, 5,6-dibromo-
SPECS
Netherlands
Tel: Update Time:2015/07/16
inquire
7. Realated Product Infomation
 
1. Names and Identifiers
2. Msds
3. Synthesis Route
4. Precursor and Product
5. Computational chemical data
6. Toltal 1 Suppliers
7. Realated Product Infomation
 
 
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