Chemical Properties of 2-Acetyl-3-methylpyrazine (CAS 23787-80-6)

2-Acetyl-3-methylpyrazine

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InChI
InChI=1S/C7H8N2O/c1-5-7(6(2)10)9-4-3-8-5/h3-4H,1-2H3
InChI Key
QUNOTZOHYZZWKQ-UHFFFAOYSA-N
Formula
C7H8N2O
SMILES
CC(=O)c1nccnc1C
Molecular Weight1
136.15
CAS
23787-80-6
Other Names
  • Ethanone, 1-(3-methylpyrazinyl)-
  • 1-(3-Methyl-2-pyrazinyl)ethanone
  • 1-[3-Methyl-2-pyrazinyl]-1-ethanone
  • 3-Acetyl-2-methylpyrazine
  • Pyrazine, 2-acetyl-3-methyl
  • Pyrazine, 3-acetyl-2-methyl
  • 1-(3-methylpyrazinyl)ethan-1-one
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Physical Properties

Property Value Unit Source
log10WS -2.14 Crippen Calculated Property
logPoct/wat 0.988 Crippen Calculated Property
McVol 107.260 ml/mol McGowan Calculated Property
Inp [1061.00; 1128.00]   Show Hide
Inp 1080.00 NIST
Inp 1097.00 NIST
Inp Outlier 1128.00 NIST
Inp 1089.00 NIST
Inp 1112.00 NIST
Inp 1061.00 NIST
Inp 1061.00 NIST
Inp 1061.00 NIST
Inp 1082.00 NIST
Inp 1069.00 NIST
Inp 1080.00 NIST
I [1615.00; 1640.00]   Show Hide
I 1628.00 NIST
I 1640.00 NIST
I 1630.00 NIST
I Outlier 1615.00 NIST
I 1635.00 NIST
I 1629.00 NIST
I 1627.00 NIST
I 1635.00 NIST
I 1635.00 NIST

Similar Compounds

Ethanone, 1-(3,5-dimethylpyrazinyl)-. 2-Acetyl-3-ethylpyrazine. Pyrazine, 2-acetyl-3,6-dimethyl. Pyrazine, 2-ethyl-3-methyl-. 1-(5-Methyl-2-pyrazinyl)-1-ethanone. 2,3-Diethylpyrazine. 2-Methyl-3-isopropylpyrazine. 1-(6-Methyl-2-pyrazinyl)-1-ethanone. Pyrazine, 2,3-diethyl-5-methyl-. Pyrazine, 3-ethyl-2,5-dimethyl-. Pyrazine, 2-ethyl-3,5-dimethyl-. 2-ethenyl-3-ethylpyrazine. Pyrazine, 3,5-diethyl-2-methyl-. 2-Methyl-3-propylpyrazine. 2,5-Diethyl-3-methylpyrazine.

Find more compounds similar to 2-Acetyl-3-methylpyrazine.

Sources

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Outlier This icon means that the value is more than 2 standard deviations away from the property mean.