| Identification | Back Directory | [Name]
4-(TERT-BUTYL)-2-CHLOROANILINE | [CAS]
42265-67-8 | [Synonyms]
4-t-butyl-2-chloroaniline
4-(TERT-BUTYL)-2-CHLOROANILINE
Benzenamine, 2-chloro-4-(1,1-dimethylethyl)- | [Molecular Formula]
C10H14ClN | [MDL Number]
MFCD00052272 | [MOL File]
42265-67-8.mol | [Molecular Weight]
183.68 |
| Chemical Properties | Back Directory | [Boiling point ]
84 °C | [density ]
1.078±0.06 g/cm3(Predicted) | [storage temp. ]
Keep in dark place,Inert atmosphere,Room temperature | [form ]
low melting solid | [pka]
2.98±0.10(Predicted) | [color ]
Colourless to light brown | [InChI]
InChI=1S/C10H14ClN/c1-10(2,3)7-4-5-9(12)8(11)6-7/h4-6H,12H2,1-3H3 | [InChIKey]
MFEZEFHCSBXPPO-UHFFFAOYSA-N | [SMILES]
C1(N)=CC=C(C(C)(C)C)C=C1Cl |
| Hazard Information | Back Directory | [Synthesis]
N-(4-(tert-butyl)-2-chlorophenyl)acetamide was used as starting material, and the acetyl deprotection reaction was carried out by treating with 20% aqueous hydrochloric acid overnight to obtain the target product 4-tert-butyl-2-chloroaniline, which was a reddish oily material with a yield of 75%. | [References]
[1] Patent: WO2011/120604, 2011, A1. Location in patent: Page/Page column 111; 132
[2] Patent: WO2005/118575, 2005, A1. Location in patent: Page/Page column 79
[3] Journal of Organic Chemistry, 1956, vol. 21, p. 736 |
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