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Home > Encyclopedia > Pyridinium, 3-carboxy-1-methyl-, 4-methylbenzenesulfonate (1:1)

Pyridinium, 3-carboxy-1-methyl-, 4-methylbenzenesulfonate (1:1)

Pyridinium, 3-carboxy-1-methyl-, 4-methylbenzenesulfonate (1:1) structure

Pyridinium, 3-carboxy-1-methyl-, 4-methylbenzenesulfonate (1:1) 

structure
  • CAS No:

    60388-20-7

  • Formula:

    C7H8NO2.C7H7O3S

  • Chemical Name:

    Pyridinium, 3-carboxy-1-methyl-, 4-methylbenzenesulfonate (1:1)

  • Synonyms:

    Pyridinium,3-carboxy-1-methyl-,4-methylbenzenesulfonate (1:1);Pyridinium,3-carboxy-1-methyl-,salt with 4-methylbenzenesulfonic acid (1:1);N-Methyl-3-carboxypyridinium tosylate

Pyridinium, 3-carboxy-1-methyl-, 4-methylbenzenesulfonate (1:1) Basic Attributes

309.3376

309.067

262-209-5

T63236EG5C

DTXSID4069399

Characteristics

107

1.19710

218ºC (decomposes)

Drug Information

trigonelline

Pyridinium, 3-carboxy-1-methyl-, 4-methylbenzenesulfonate (1:1) Use and Manufacturing

Pyridinium, 3-carboxy-1-methyl-, 4-methylbenzenesulfonate (1:1): INACTIVE

Computed Properties

Molecular Weight:309.34
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:309.06709375
Monoisotopic Mass:309.06709375
Topological Polar Surface Area:107
Heavy Atom Count:21
Complexity:329
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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