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CAS 77-49-6

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2-Methyl-2-nitro-1,3-propanediol

Description:
2-Methyl-2-nitro-1,3-propanediol, with the CAS number 77-49-6, is an organic compound characterized by the presence of both a nitro group and hydroxyl groups in its structure. It is a colorless to pale yellow solid at room temperature and is soluble in water and various organic solvents. The compound features a three-carbon backbone with a methyl group and a nitro group attached to the second carbon, along with hydroxyl groups on the first and third carbons. This configuration contributes to its reactivity, making it useful in various chemical applications, including as an intermediate in organic synthesis. The presence of the nitro group imparts certain electrophilic properties, while the hydroxyl groups can participate in hydrogen bonding, influencing its solubility and interaction with other substances. Safety data indicates that it should be handled with care, as it may pose health risks upon exposure. Overall, 2-Methyl-2-nitro-1,3-propanediol is a versatile compound with applications in chemical research and industry.
Formula:C4H9NO4
InChI:InChI=1S/C4H9NO4/c1-4(2-6,3-7)5(8)9/h6-7H,2-3H2,1H3
InChI key:InChIKey=LOTYADDQWWVBDJ-UHFFFAOYSA-N
SMILES:C(N(=O)=O)(CO)(CO)C
Synonyms:
  • 1,1-Dimethylol-1-nitroethane
  • 1,3-Propanediol, 2-methyl-2-nitro-
  • 2-Methyl-2-Nitropropane-1,3-Diol
  • 2-Methyl-2-nitro-1,3-propanediol
  • NSC 5372
  • Nitroisobutylglycol
  • 2-Nitro-2-methyl-1,3-propanediol
  • NMPD
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