Home Halogens 4,7-Dibromo-5,6-bis(octyloxy)benzo[c][1,2,5]thiadiazole

4,7-Dibromo-5,6-bis(octyloxy)benzo[c][1,2,5]thiadiazole

CAS No.:
1192352-08-1
Catalog Number:
AG000IF5
Molecular Formula:
C22H34Br2N2O2S
Molecular Weight:
550.3906
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
200mg
>98.0%(GC)
1 week
United States
$569
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Product Description
Catalog Number:
AG000IF5
Chemical Name:
4,7-Dibromo-5,6-bis(octyloxy)benzo[c][1,2,5]thiadiazole
CAS Number:
1192352-08-1
Molecular Formula:
C22H34Br2N2O2S
Molecular Weight:
550.3906
MDL Number:
MFCD19440967
IUPAC Name:
4,7-dibromo-5,6-dioctoxy-2,1,3-benzothiadiazole
InChI:
InChI=1S/C22H34Br2N2O2S/c1-3-5-7-9-11-13-15-27-21-17(23)19-20(26-29-25-19)18(24)22(21)28-16-14-12-10-8-6-4-2/h3-16H2,1-2H3
InChI Key:
VGCVJZVDAAWTFC-UHFFFAOYSA-N
SMILES:
CCCCCCCCOc1c(OCCCCCCCC)c(Br)c2c(c1Br)nsn2
Properties
Complexity:
386  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
550.069g/mol
Formal Charge:
0
Heavy Atom Count:
29  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
550.394g/mol
Monoisotopic Mass:
548.071g/mol
Rotatable Bond Count:
16  
Topological Polar Surface Area:
72.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
10  
Properties