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| CAS No.: | 1635-61-6 |
|---|---|
| Name: | 5-Chloro-2-nitroaniline |
| Article Data: | 43 |
| Molecular Structure: | |
|
|
|
| Formula: | C6H5ClN2O2 |
| Molecular Weight: | 172.571 |
| Synonyms: | Benzenamine, 5-chloro-2-nitro- (9CI);5-Chloro-2-nitrobenzenamine;3-Chloro-6-nitroaniline;Aniline, 5-chloro-2-nitro- (8CI);Aniline, 5-chloro-2-nitro-;Benzenamine, 5-chloro-2-nitro-;2-Nitro-5-chloroaniline; |
| EINECS: | 216-661-5 |
| Density: | 1.494 g/cm3 |
| Melting Point: | 125-129 °C (dec.)(lit.) |
| Boiling Point: | 323.4 °C at 760 mmHg |
| Flash Point: | 149.4 °C |
| Appearance: | yellow to orange powder |
| Hazard Symbols: |
 T+, N, T
|
| Risk Codes: | 26/27/28-33-51/53 |
| Safety: | 28-36/37-45-61-28A |
| Transport Information: | UN 2237 6.1/PG 3 |
| PSA: | 71.84000 |
| LogP: | 2.93480 |
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Chemistry
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IUPAC Name: 5-Chloro-2-nitroaniline
Canonical SMILES: C1=CC(=C(C=C1Cl)N)[N+](=O)[O-]
InChI: InChI=1S/C6H5ClN2O2/c7-4-1-2-6(9(10)11)5(8)3-4/h1-3H,8H2
InChIKey: ZCWXYZBQDNFULS-UHFFFAOYSA-N
Molecular Weight: 172.5691 [g/mol]
Molecular Formula: C6H5ClN2O2
XLogP3: 2.7
H-Bond Donor: 1
H-Bond Acceptor: 3
EINECS: 216-661-5
Product Categories: API intermediates
Index of Refraction: 1.646
Molar Refractivity: 41.92 cm3
Molar Volume: 115.5 cm3
Surface Tension: 62.2 dyne/cm
Density: 1.494 g/cm3
Flash Point: 149.4 °C
Enthalpy of Vaporization: 56.54 kJ/mol
Boiling Point: 323.4 °C at 760 mmHg
Vapour Pressure: 0.000262 mmHg at 25 °C
Appearance: yellow to orange powder
Melting Point of 5-Chloro-2-nitroaniline (CAS NO.1635-61-6): 125-129 °C (dec.)(lit.)
Safety Profile
Hazard Codes: 
T+, 
N,
T
The Risk Statements:
33: Danger of cumulative effects
26/27/28: Very Toxic by inhalation, in contact with skin and if swallowed
51/53: Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment
Safety Statements:
28: After contact with skin, wash immediately with plenty of soap-suds .
45: In case of accident or if you feel unwell, seek medical advice immediately (show label where possible)
61: Avoid release to the environment. Refer to special instructions safety data sheet
36/37: Wear suitable protective clothing and gloves
Hazard Note: Irritant
HazardClass: 6.1
RIDADR: UN 2237 6.1/PG 3
WGK Germany: 3
PackingGroup: III
Specification
5-Chloro-2-nitroaniline (CAS NO.1635-61-6), its Synonyms are 2-Nitro-5-chloroaniline ; 3-Chloro-6-nitroaniline ; 5-Chloro-2-nitrobenzeneamine ; Aniline, 5-chloro-2-nitro- (8CI) ; Benzenamine, 5-chloro-2-nitro- (9CI) .