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3-Chloro-5-methoxybenzenamine

3-Chloro-5-methoxybenzenamine structure

3-Chloro-5-methoxybenzenamine 

structure
  • CAS No:

    10272-06-7

  • Formula:

    C7H8ClNO

  • Chemical Name:

    3-Chloro-5-methoxybenzenamine

  • Synonyms:

    Benzenamine,3-chloro-5-methoxy-;m-Anisidine,5-chloro-;3-Chloro-5-methoxybenzenamine;3-Chloro-5-methoxyaniline

  • Categories:

    Chemical Reagents  >  Organic Reagents

3-Chloro-5-methoxybenzenamine Basic Attributes

157.59752

157.60

233-614-4

DTXSID60145466

2922299090

Characteristics

35.2

2.5

1.234±0.06 g/cm3(Predicted)

33 °C

280.3±20.0 °C(Predicted)

123.3±21.8 °C

1.573

Safety Information

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501|The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

3-Chloro-5-methoxybenzenamine Use and Manufacturing

Methods of Manufacturing

General procedure: To a solution of ethyl 4-bromo-1H-indole-2-carboxylate in toluene underargon atmosphere was added Pd2(dba)3 (0.1 eq), DavePhos (0.2 eq), K3PO4 (3 eq, 1Maqueous solution) and aryl amine (3 eq), and then the mixture was reacted at 80 Cuntil the starting material disappeared. The mixture was cooled to room temperatureand concentrated. Ethyl acetate was added to dissolve the residue and the mixture waswashed with saturated brine and water, dried over anhydrous Na2SO4, andconcentrated in vacuo. The crude product was purified by column chromatography toafford the target compound. Compounds 8a-8f, 8i-8l, 8a-1, 8a-6 ~ 8a-11, 8a-14 wereprepared with method 1.

Uses

3-Chloro-5-methoxyaniline is an intermediate used in the synthetic preparation of various pharmaceutical goods.

Computed Properties

Molecular Weight:157.60
XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:157.0294416
Monoisotopic Mass:157.0294416
Topological Polar Surface Area:35.2
Heavy Atom Count:10
Complexity:110
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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