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29461-04-9 | Pyrazine, 2-butyl-5-methyl-
CAS No: 29461-04-9 Catalog No: AG002YFQ MDL No:
Product Description
Catalog Number:
AG002YFQ
Chemical Name:
Pyrazine, 2-butyl-5-methyl-
CAS Number:
29461-04-9
Molecular Formula:
C9H14N2
Molecular Weight:
150.2209
IUPAC Name:
2-butyl-5-methylpyrazine
InChI:
InChI=1S/C9H14N2/c1-3-4-5-9-7-10-8(2)6-11-9/h6-7H,3-5H2,1-2H3
InChI Key:
ICMOJSQWNJQRQI-UHFFFAOYSA-N
SMILES:
CCCCc1cnc(cn1)C
Properties
Complexity:
104
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
150.116g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
150.225g/mol
Monoisotopic Mass:
150.116g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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