Home Halogens 2,6-Dibromo-4,4-bis(2-ethylhexyl)-4H-cyclopenta[2,1-b

2,6-Dibromo-4,4-bis(2-ethylhexyl)-4H-cyclopenta[2,1-b

CAS No.:
365547-21-3
Catalog Number:
AG00CAUB
Molecular Formula:
C25H36Br2S2
Molecular Weight:
560.4913
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
200mg
>99.0%(HPLC)
1 week
United States
$430
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Product Description
Catalog Number:
AG00CAUB
Chemical Name:
2,6-Dibromo-4,4-bis(2-ethylhexyl)-4H-cyclopenta[2,1-b
CAS Number:
365547-21-3
Molecular Formula:
C25H36Br2S2
Molecular Weight:
560.4913
MDL Number:
MFCD16619302
IUPAC Name:
4,10-dibromo-7,7-bis(2-ethylhexyl)-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene
InChI:
InChI=1S/C25H36Br2S2/c1-5-9-11-17(7-3)15-25(16-18(8-4)12-10-6-2)19-13-21(26)28-23(19)24-20(25)14-22(27)29-24/h13-14,17-18H,5-12,15-16H2,1-4H3
InChI Key:
NEQRAFHWWLGKEJ-UHFFFAOYSA-N
SMILES:
CCCCC(CC1(CC(CCCC)CC)c2cc(sc2c2c1cc(s2)Br)Br)CC
Properties
Complexity:
455  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
560.06g/mol
Formal Charge:
0
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
560.491g/mol
Monoisotopic Mass:
558.063g/mol
Rotatable Bond Count:
12  
Topological Polar Surface Area:
56.5A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
12.9  
Properties