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560235 Sigma-Aldrich

4-Benzylaniline

97%

Synonym: 4-Aminodiphenylmethane

  • CAS Number 1135-12-2

  • Linear Formula C6H5CH2C6H4NH2

  • Molecular Weight 183.25

  •  MDL number MFCD00047861

  •  PubChem Substance ID 24879856

  •  NACRES NA.22

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Properties

Related Categories Amines, Building Blocks, C13, Chemical Synthesis, Nitrogen Compounds - Organic Building Blocks,
Quality Level   100
assay   97%
mp   35-38 °C (lit.)
SMILES string   Nc1ccc(Cc2ccccc2)cc1
InChI   1S/C13H13N/c14-13-8-6-12(7-9-13)10-11-4-2-1-3-5-11/h1-9H,10,14H2
InChI key   WDTRNCFZFQIWLM-UHFFFAOYSA-N

Description

General description

4-Benzylaniline (4-BA) undergoes hydrochlorination in the presence of HCl to yield 4-benzylaniline hydrochloride. Crystals of 4-BA exhibit monoclinic crystal system and space group P21/c.

Application

4-Benzylaniline (4-Aminodiphenylmethane) can be used to synthesize:
• 2-amino-6-benzylbenzothiazole (SKA-7)
• ethyl 2-((4-benzylphenylamino)methylen)-malonate
• bis(4-benzylphenyl)-urea
• 3:5-dibromo-4-aminodiphenylmethane via treatment with bromine solution
• 3:5-di-iodo-4-aminodiphenylmethane via iodination reaction by using a suitable iodinating reagent[sodium iodate + potassium iodide]

Packaging

1, 5 g in glass bottle

Safety & Documentation

Safety Information

Personal Protective Equipment 
RIDADR 
NONH for all modes of transport
WGK Germany 
WGK 3
Flash Point(F) 
230.0 °F - closed cup
Flash Point(C) 
110 °C - closed cup

Documents

Certificate of Analysis (COA)

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Meet Synthia - Retrosynthesis Sofware
Protocols & Articles
Peer-Reviewed Papers
15

References

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