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Home > Bromides > 1159554-51-4
1159554-51-4 | 1,2,4-Triazolo[4,3-a]pyrazine, 3-bromo-
CAS No: 1159554-51-4 Catalog No: AG000H7P MDL No:MFCD11856748
Product Description
Catalog Number:
AG000H7P
Chemical Name:
1,2,4-Triazolo[4,3-a]pyrazine, 3-bromo-
CAS Number:
1159554-51-4
Molecular Formula:
C5H3BrN4
Molecular Weight:
199.0081
MDL Number:
MFCD11856748
IUPAC Name:
3-bromo-[1,2,4]triazolo[4,3-a]pyrazine
InChI:
InChI=1S/C5H3BrN4/c6-5-9-8-4-3-7-1-2-10(4)5/h1-3H
InChI Key:
QIUBYSDTNUNOLW-UHFFFAOYSA-N
SMILES:
Brc1nnc2n1ccnc2
Properties
Complexity:
131
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
197.954g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
199.011g/mol
Monoisotopic Mass:
197.954g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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