6-butan-2-yl-3-(2-methylpropyl)-1H-pyrazin-2-one
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6-butan-2-yl-3-(2-methylpropyl)-1H-pyrazin-2-one
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CAS No:
21641-71-4
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Formula:
C12H20N2O
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Chemical Name:
6-butan-2-yl-3-(2-methylpropyl)-1H-pyrazin-2-one
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Synonyms:
NSC127441;Deoxyaspergillic acid;21641-71-4;6-butan-2-yl-3-(2-methylpropyl)-1H-pyrazin-2-one;ASPERGILLIC ACID, DEOXY-;CHEMBL1966966;DTXSID70299000;NSC-127441;NCI60_000622;6-(sec-Butyl)-3-isobutylpyrazin-2(1H)-one;3-Isobutyl-6-[(R)-sec-butyl]pyrazin-2(1H)-one
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CAS No:
6-butan-2-yl-3-(2-methylpropyl)-1H-pyrazin-2-one Basic Attributes
208.30 g/mol
208.157563266 g/mol
127441
DTXSID70299000
Computed Properties
Molecular Weight:208.30
XLogP3:2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:4
Exact Mass:208.157563266
Monoisotopic Mass:208.157563266
Topological Polar Surface Area:41.5
Heavy Atom Count:15
Complexity:303
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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