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1753-75-9

1753-75-9 | 2,1,3-Benzothiadiazole, 5-bromo-

CAS No: 1753-75-9 Catalog No: AG0020WR MDL No:MFCD00460091

Product Description

Catalog Number:
AG0020WR
Chemical Name:
2,1,3-Benzothiadiazole, 5-bromo-
CAS Number:
1753-75-9
Molecular Formula:
C6H3BrN2S
Molecular Weight:
215.0704
MDL Number:
MFCD00460091
IUPAC Name:
5-bromo-2,1,3-benzothiadiazole
InChI:
InChI=1S/C6H3BrN2S/c7-4-1-2-5-6(3-4)9-10-8-5/h1-3H
InChI Key:
LLCRUZDFDGTAAN-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)nsn2

Properties

Complexity:
133  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
213.92g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
215.068g/mol
Monoisotopic Mass:
213.92g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  

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