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71566-70-6 | 2,5-dibromohexa-1,5-diene
CAS No: 71566-70-6 Catalog No: AG005GRE MDL No:
Product Description
Catalog Number:
AG005GRE
Chemical Name:
2,5-dibromohexa-1,5-diene
CAS Number:
71566-70-6
Molecular Formula:
C6H8Br2
Molecular Weight:
239.9357
IUPAC Name:
2,5-dibromohexa-1,5-diene
InChI:
InChI=1S/C6H8Br2/c1-5(7)3-4-6(2)8/h1-4H2
InChI Key:
NVITZDSUVOEWEO-UHFFFAOYSA-N
SMILES:
BrC(=C)CCC(=C)Br
Properties
Complexity:
91.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
239.897g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
239.938g/mol
Monoisotopic Mass:
237.899g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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