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98006-90-7

98006-90-7 | 2-Bromo-5-methylpyrazine

CAS No: 98006-90-7 Catalog No: AG0038IS MDL No:MFCD08705754

Product Description

Catalog Number:
AG0038IS
Chemical Name:
2-Bromo-5-methylpyrazine
CAS Number:
98006-90-7
Molecular Formula:
C5H5BrN2
Molecular Weight:
173.0106
MDL Number:
MFCD08705754
IUPAC Name:
2-bromo-5-methylpyrazine
InChI:
InChI=1S/C5H5BrN2/c1-4-2-8-5(6)3-7-4/h2-3H,1H3
InChI Key:
OBZRGWKVWAXNKZ-UHFFFAOYSA-N
SMILES:
Cc1ncc(nc1)Br

Properties

Complexity:
76.8  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
171.964g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
173.013g/mol
Monoisotopic Mass:
171.964g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  

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