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114458-15-0 | Pyrazine, 2-propyl-5-(4-propylphenyl)-
CAS No: 114458-15-0 Catalog No: AG000EF7 MDL No:
Product Description
Catalog Number:
AG000EF7
Chemical Name:
Pyrazine, 2-propyl-5-(4-propylphenyl)-
CAS Number:
114458-15-0
Molecular Formula:
C16H20N2
Molecular Weight:
240.3434
IUPAC Name:
2-propyl-5-(4-propylphenyl)pyrazine
InChI:
InChI=1S/C16H20N2/c1-3-5-13-7-9-14(10-8-13)16-12-17-15(6-4-2)11-18-16/h7-12H,3-6H2,1-2H3
InChI Key:
SWHWVLYYFYKXJX-UHFFFAOYSA-N
SMILES:
CCCc1ccc(cc1)c1ncc(nc1)CCC
Properties
Complexity:
221
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.163g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.35g/mol
Monoisotopic Mass:
240.163g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
25.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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