Product Name3,5-Dichloroaniline
CAS626-43-7
Molecular FormulaC6H5Cl2N
Molecular Weight162.02
InChIInChI=1S/C6H5Cl2N/c7-4-1-5(8)3-6(9)2-4/h1-3H,9H2
InChIKey UQRLKWGPEVNVHT-UHFFFAOYSA-N
SmilesC1(N)=CC(Cl)=CC(Cl)=C1

Mass
MS-NW-1615 3,5-dichloroaniline C6H5Cl2N (Mass of molecular ion: 161)
Source Temperature: 240 °C Sample Temperature: 180 °C Reservoir, 75 eV
28.0 2.7
37.0 2.5
38.0 3.0
39.0 3.0
41.0 2.8
44.5 4.2
45.5 1.3
49.0 1.0
50.0 1.4
52.0 3.6
61.0 3.4
62.0 5.9
62.5 4.9
63.0 13.4
63.5 1.5
64.0 3.2
65.0 2.2
73.0 4.6
74.0 1.7
75.0 1.7
80.5 4.5
81.5 2.9
88.0 1.0
89.0 2.2
90.0 17.1
91.0 4.5
97.0 1.4
98.0 2.3
99.0 14.8
100.0 1.7
101.0 5.1
124.0 1.0
125.0 6.5
126.0 12.2
127.0 2.8
128.0 3.8
133.0 3.2
134.0 4.3
135.0 2.4
136.0 2.6
160.0 1.0
161.0 100.0
162.0 7.5
163.0 64.0
164.0 4.6
165.0 10.2
90 MHz in CDCl3

| 1H NMR | 89.56 MHz |
| C6 H5 Cl2 N | 0.044 g : 0.5 ml CDCl3 |
| 3,5-dichloroaniline | |
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Assign. Shift(ppm) |
Hz ppm Int.
603.06 6.734 190
601.25 6.714 367
599.56 6.695 297
584.75 6.530 1000
583.00 6.510 817
581.44 6.493 42
338.44 3.779 43
in CDCl3

CCl4 solution

KBr disc

nujol mull


OXIDATION WITH PERBENZOIC ACID

3,5-Dichloroaniline(626-43-7) 13C NMR Atlas of Related Products
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