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137232-62-3 | 2(1H)-Pyrazinone, 1,6-dimethyl-
CAS No: 137232-62-3 Catalog No: AG0012Z5 MDL No:
Product Description
Catalog Number:
AG0012Z5
Chemical Name:
2(1H)-Pyrazinone, 1,6-dimethyl-
CAS Number:
137232-62-3
Molecular Formula:
C6H8N2O
Molecular Weight:
124.1405
IUPAC Name:
1,6-dimethylpyrazin-2-one
InChI:
InChI=1S/C6H8N2O/c1-5-3-7-4-6(9)8(5)2/h3-4H,1-2H3
InChI Key:
MVOFQFRALBXVIA-UHFFFAOYSA-N
SMILES:
Cn1c(C)cncc1=O
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
124.064g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
124.143g/mol
Monoisotopic Mass:
124.064g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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