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116605-69-7 | Pyrido[2,3-b]pyrazine, 7-bromo-8-methyl-
CAS No: 116605-69-7 Catalog No: AG000CV2 MDL No:MFCD09881188
Product Description
Catalog Number:
AG000CV2
Chemical Name:
Pyrido[2,3-b]pyrazine, 7-bromo-8-methyl-
CAS Number:
116605-69-7
Molecular Formula:
C8H6BrN3
Molecular Weight:
224.0573
MDL Number:
MFCD09881188
IUPAC Name:
7-bromo-8-methylpyrido[2,3-b]pyrazine
InChI:
InChI=1S/C8H6BrN3/c1-5-6(9)4-12-8-7(5)10-2-3-11-8/h2-4H,1H3
InChI Key:
BHHMPZQRVWVAAR-UHFFFAOYSA-N
SMILES:
Brc1cnc2c(c1C)nccn2
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.975g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
224.061g/mol
Monoisotopic Mass:
222.975g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
38.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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