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1420670-22-9 | Imidazo[1,2-a]pyrazine-8-carboxylic acid, 3,6-dibromo-, methyl ester
CAS No: 1420670-22-9 Catalog No: AG001HOB MDL No:
Product Description
Catalog Number:
AG001HOB
Chemical Name:
Imidazo[1,2-a]pyrazine-8-carboxylic acid, 3,6-dibromo-, methyl ester
CAS Number:
1420670-22-9
Molecular Formula:
C8H5Br2N3O2
Molecular Weight:
334.9522
IUPAC Name:
methyl 3,6-dibromoimidazo[1,2-a]pyrazine-8-carboxylate
InChI:
InChI=1S/C8H5Br2N3O2/c1-15-8(14)6-7-11-2-5(10)13(7)3-4(9)12-6/h2-3H,1H3
InChI Key:
FIRWZPRXRGWXIC-UHFFFAOYSA-N
SMILES:
COC(=O)c1nc(Br)cn2c1ncc2Br
Properties
Complexity:
266
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
334.873g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
334.955g/mol
Monoisotopic Mass:
332.875g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
56.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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