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125223-87-2

125223-87-2 | 1,3,5-Hexatriene, 1,1,2,3,4,5,6,6-octabromo-

CAS No: 125223-87-2 Catalog No: AG000NDM MDL No:

Product Description

Catalog Number:
AG000NDM
Chemical Name:
1,3,5-Hexatriene, 1,1,2,3,4,5,6,6-octabromo-
CAS Number:
125223-87-2
Molecular Formula:
C6Br8
Molecular Weight:
711.2962
IUPAC Name:
1,1,2,3,4,5,6,6-octabromohexa-1,3,5-triene
InChI:
InChI=1S/C6Br8/c7-1(3(9)5(11)12)2(8)4(10)6(13)14
InChI Key:
SHSJRNKUCHCRFT-UHFFFAOYSA-N
SMILES:
BrC(=C(C(=C(Br)Br)Br)Br)C(=C(Br)Br)Br

Properties

Complexity:
283  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
711.339g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
711.298g/mol
Monoisotopic Mass:
703.347g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
6.9  

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