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Home > Encyclopedia > 6-Chloro-N,N-dimethyl-4-pyrimidinamine

6-Chloro-N,N-dimethyl-4-pyrimidinamine

6-Chloro-N,N-dimethyl-4-pyrimidinamine structure

6-Chloro-N,N-dimethyl-4-pyrimidinamine 

structure
  • CAS No:

    31058-83-0

  • Formula:

    C6H8ClN3

  • Chemical Name:

    6-Chloro-N,N-dimethyl-4-pyrimidinamine

  • Synonyms:

    4-Pyrimidinamine,6-chloro-N,N-dimethyl-;Pyrimidine,4-chloro-6-(dimethylamino)-;6-Chloro-N,N-dimethyl-4-pyrimidinamine;4-Chloro-6-(dimethylamino)pyrimidine;(6-Chloropyrimidin-4-yl)dimethylamine;6-Chloro-N,N-dimethylpyrimidin-4-amine

  • Categories:

    Pharmaceutical Intermediates  >  Heterocyclic Compound

6-Chloro-N,N-dimethyl-4-pyrimidinamine Basic Attributes

157.60082

157.60

DTXSID70551615

2933599090

Characteristics

29

1.6

1.3±0.1 g/cm3

102-103 °C

271.4°C at 760 mmHg

117.9±21.8 °C

1.576

Safety Information

IRRITANT

NONH for all modes of transport

43

36/37

P280

H302-H317

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

6-Chloro-N,N-dimethyl-4-pyrimidinamine Use and Manufacturing

To a mixture of (S)-tert-butyl 4-((2-acetamidoethyl) (4-(5, 6, 7, 8-tetrahydro-1, 8-naphthyridin-2-yl) butyl)amino)-2-aminobutanoate (100 mg, 223 mumol) and To a mixture of (S)-tert-butyl 2-amino-4-(((S)-2-fluoro-3-methoxypropyl) (4-(5, 6, 7, 8-tetrahydro-1, 8-naphthyridin-2-yl) butyl)amino) butanoate (150 mg, 331 mumol) and To a mixture of tert-butyl (S)-2-amino-4-(((R)-2-methoxypropyl) (4-(5, 6, 7, 8-tetrahydro-1, 8-naphthyridin-2-yl) butyl)amino) butanoate (152 mg, 349 mumol) and 6-chloro-N, N-dimethyl-pyrimidin-4-amine (46 mg, 291 mumol) in t-AmOH (3 mL) was added 2.0M t-BuONa in THF (291 muL, 582 mumol) then tBuXPhos-Pd-G3 (23 mg, 29 mumol) and the resulting mixture was heated to 100 C. for 2 h. The reaction mixture was cooled to rt and then concentrated in vacuo to give the title compound that was used without further purification. LCMS (ESI+): m/z=556.6 (M+H)+.

Computed Properties

Molecular Weight:157.60
XLogP3:1.6
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:157.0406750
Monoisotopic Mass:157.0406750
Topological Polar Surface Area:29
Heavy Atom Count:10
Complexity:107
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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