Home Halogens 2-bromo-5-(4-chlorophenyl)-1,3,4-thiadiazole

2-bromo-5-(4-chlorophenyl)-1,3,4-thiadiazole

CAS No.:
57709-58-7
Catalog Number:
AG019TQX
Molecular Formula:
C8H4BrClN2S
Molecular Weight:
275.5528
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Product Description
Catalog Number:
AG019TQX
Chemical Name:
2-bromo-5-(4-chlorophenyl)-1,3,4-thiadiazole
CAS Number:
57709-58-7
Molecular Formula:
C8H4BrClN2S
Molecular Weight:
275.5528
MDL Number:
MFCD18344983
IUPAC Name:
2-bromo-5-(4-chlorophenyl)-1,3,4-thiadiazole
InChI:
InChI=1S/C8H4BrClN2S/c9-8-12-11-7(13-8)5-1-3-6(10)4-2-5/h1-4H
InChI Key:
BCYOCBCOIDTQRC-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)c1nnc(s1)Br
Properties
Complexity:
176  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.897g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
275.548g/mol
Monoisotopic Mass:
273.897g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties