4-(dimethylaminomethylidene)-3-(methoxymethyl)-1H-pyrazol-5-one

Base Information

• Chemical Name: 4-(dimethylaminomethylidene)-3-(methoxymethyl)-1H-pyrazol-5-one
• CAS No.: 240799-57-9
• Molecular Formula: C8H13N3O2
• Molecular Weight: 183.21
• Mol file: 240799-57-9.mol

Synonyms:240799-57-9;4-(dimethylaminomethylidene)-3-(methoxymethyl)-1H-pyrazol-5-one;4-[(dimethylamino)methylene]-5-(methoxymethyl)-2,4-dihydro-3H-pyrazol-3-one;4-[(dimethylamino)methylidene]-3-(methoxymethyl)-4,5-dihydro-1H-pyrazol-5-one;AKOS005073979;10B-079

Chemical Property of 4-(dimethylaminomethylidene)-3-(methoxymethyl)-1H-pyrazol-5-one

Chemical Property:

• PKA: 9.41±0.40(Predicted)
• XLogP3: -0.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 183.100776666
• Heavy Atom Count: 13
• Complexity: 269

Purity/Quality:

4-[(Dimethylamino)methylene]-5-(methoxymethyl)-2,4-dihydro-3H-pyrazol-3-one ^*data from reagent suppliers

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: CN(C)C=C1C(=NNC1=O)COC

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