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15986-80-8 | Pyrazine, 2-methyl-3-propyl-
CAS No: 15986-80-8 Catalog No: AG001RH5 MDL No:MFCD00010096
Product Description
Catalog Number:
AG001RH5
Chemical Name:
Pyrazine, 2-methyl-3-propyl-
CAS Number:
15986-80-8
Molecular Formula:
C8H12N2
Molecular Weight:
136.1943
MDL Number:
MFCD00010096
IUPAC Name:
2-methyl-3-propylpyrazine
InChI:
InChI=1S/C8H12N2/c1-3-4-8-7(2)9-5-6-10-8/h5-6H,3-4H2,1-2H3
InChI Key:
XAWKNALRUSOTOY-UHFFFAOYSA-N
SMILES:
Cc1nccnc1CCC
EC Number:
240-121-8
Properties
Complexity:
93.3
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
136.1g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
136.198g/mol
Monoisotopic Mass:
136.1g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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