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15986-96-6 | Pyrazine, 2-butyl-5,6-dihydro-3-methyl-
CAS No: 15986-96-6 Catalog No: AG001RH1 MDL No:MFCD00047389
Product Description
Catalog Number:
AG001RH1
Chemical Name:
Pyrazine, 2-butyl-5,6-dihydro-3-methyl-
CAS Number:
15986-96-6
Molecular Formula:
C9H16N2
Molecular Weight:
152.2367
MDL Number:
MFCD00047389
IUPAC Name:
5-butyl-6-methyl-2,3-dihydropyrazine
InChI:
InChI=1S/C9H16N2/c1-3-4-5-9-8(2)10-6-7-11-9/h3-7H2,1-2H3
InChI Key:
PATGXOSMIGXGKT-UHFFFAOYSA-N
SMILES:
CC1=NCCN=C1CCCC
EC Number:
240-124-4
Properties
Complexity:
180
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.131g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
152.241g/mol
Monoisotopic Mass:
152.131g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
24.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6
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