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1001050-18-5 | 2-Pyrazinamine, 5-bromo-N-ethyl-
CAS No: 1001050-18-5 Catalog No: AG0000YM MDL No:MFCD09881408
Product Description
Catalog Number:
AG0000YM
Chemical Name:
2-Pyrazinamine, 5-bromo-N-ethyl-
CAS Number:
1001050-18-5
Molecular Formula:
C6H8BrN3
Molecular Weight:
202.0518
MDL Number:
MFCD09881408
IUPAC Name:
5-bromo-N-ethylpyrazin-2-amine
InChI:
InChI=1S/C6H8BrN3/c1-2-8-6-4-9-5(7)3-10-6/h3-4H,2H2,1H3,(H,8,10)
InChI Key:
BTOIVOKUYWVHBG-UHFFFAOYSA-N
SMILES:
CCNc1cnc(cn1)Br
Properties
Complexity:
99
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.99g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
202.055g/mol
Monoisotopic Mass:
200.99g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
37.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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