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10132-44-2 | Pyrazine, 2,5-dimethyl-3,6-bis(3-methylbutyl)-
CAS No: 10132-44-2 Catalog No: AG000482 MDL No:
Product Description
Catalog Number:
AG000482
Chemical Name:
Pyrazine, 2,5-dimethyl-3,6-bis(3-methylbutyl)-
CAS Number:
10132-44-2
Molecular Formula:
C16H28N2
Molecular Weight:
248.4069
IUPAC Name:
2,5-dimethyl-3,6-bis(3-methylbutyl)pyrazine
InChI:
InChI=1S/C16H28N2/c1-11(2)7-9-15-13(5)18-16(14(6)17-15)10-8-12(3)4/h11-12H,7-10H2,1-6H3
InChI Key:
ZTYXYAQOYRIOET-UHFFFAOYSA-N
SMILES:
CC(CCc1nc(C)c(nc1C)CCC(C)C)C
Properties
Complexity:
201
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
248.225g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
248.414g/mol
Monoisotopic Mass:
248.225g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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