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15987-00-5 | Pyrazine, 2-butyl-3-methyl-
CAS No: 15987-00-5 Catalog No: AG001RGZ MDL No:MFCD00038031
Product Description
Catalog Number:
AG001RGZ
Chemical Name:
Pyrazine, 2-butyl-3-methyl-
CAS Number:
15987-00-5
Molecular Formula:
C9H14N2
Molecular Weight:
150.2209
MDL Number:
MFCD00038031
IUPAC Name:
2-butyl-3-methylpyrazine
InChI:
InChI=1S/C9H14N2/c1-3-4-5-9-8(2)10-6-7-11-9/h6-7H,3-5H2,1-2H3
InChI Key:
IRSIKJPEFMMRHD-UHFFFAOYSA-N
SMILES:
Cc1nccnc1CCCC
EC Number:
240-126-5
UNII:
SLG6RBP4ZT
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:
2.1
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