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Home > Bromides > 1373253-24-7
1373253-24-7 | Imidazo[2,1-b]-1,3,4-thiadiazole-6-carboxylic acid, 2-bromo-
CAS No: 1373253-24-7 Catalog No: AG001351 MDL No:MFCD13193514
Product Description
Catalog Number:
AG001351
Chemical Name:
Imidazo[2,1-b]-1,3,4-thiadiazole-6-carboxylic acid, 2-bromo-
CAS Number:
1373253-24-7
Molecular Formula:
C5H2BrN3O2S
Molecular Weight:
248.0573
MDL Number:
MFCD13193514
IUPAC Name:
2-bromoimidazo[2,1-b][1,3,4]thiadiazole-6-carboxylic acid
InChI:
InChI=1S/C5H2BrN3O2S/c6-4-8-9-1-2(3(10)11)7-5(9)12-4/h1H,(H,10,11)
InChI Key:
WIJRPAZEAZYPEQ-UHFFFAOYSA-N
SMILES:
OC(=O)c1cn2c(n1)sc(n2)Br
Properties
Complexity:
217
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.905g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
248.054g/mol
Monoisotopic Mass:
246.905g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
95.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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