| Identification | Back Directory | [Name]
1-CHLOROBENZOTRIAZOLE | [CAS]
21050-95-3 | [Synonyms]
NSC 186037
1-CHLOROBENZOTRIAZOLE
N-Chlorobenzotriazole
1-chloro-1H-benzotriazole
1H-Benzotriazole, 1-chloro-
1-Chloro-1H-1,2,3-benzotriazole
1-chloro-1H-benzo[d][1,2,3]triazole | [EINECS(EC#)]
244-171-1 | [Molecular Formula]
C6H4ClN3 | [MDL Number]
MFCD00054541 | [MOL File]
21050-95-3.mol | [Molecular Weight]
153.57 |
| Chemical Properties | Back Directory | [Melting point ]
104-106?C | [Boiling point ]
252.42°C (rough estimate) | [density ]
1.3647 (rough estimate) | [refractive index ]
1.6010 (estimate) | [storage temp. ]
-20°C Freezer, Under Inert Atmosphere | [solubility ]
Chloroform (Slightly), Ethyl Acetate (Slightly) | [form ]
Solid | [pka]
-0.96±0.30(Predicted) | [color ]
White to Off-White | [InChI]
InChI=1S/C6H4ClN3/c7-10-6-4-2-1-3-5(6)8-9-10/h1-4H | [InChIKey]
INOGLHRUEYDAHX-UHFFFAOYSA-N | [SMILES]
N1(Cl)C2=CC=CC=C2N=N1 |
| Safety Data | Back Directory | [Hazard Codes ]
Xn | [Risk Statements ]
22-36/37/38 | [Safety Statements ]
26 | [WGK Germany ]
3 | [HS Code ]
29339900 | [Storage Class]
11 - Combustible Solids | [Hazard Classifications]
Acute Tox. 4 Oral
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3 |
| Hazard Information | Back Directory | [Chemical Properties]
White Solid | [Uses]
Oxidation | [Uses]
Oxidation and chlorination reagent. | [Application]
Used as positive halogen reagent for mild oxidations and selective chlorinations. | [Synthesis]
1-Chlorobenzotriazole is prepared by treat benzotriazole with sodium hypochlorite in 50% aq acetic acid. The reagent quickly precipitates and is obtained in nearly quantitative yield after recrystallization from CH2Cl2/petroleum ether. | [storage]
1-Chlorobenzotriazole may ignite spontaneously; reacts explosively with DMSO; light sensitive; stable to air and moisture in brown bottles; storage recommended at 0 °C; discard or repurify if discoloration occurs. This reagent should be handled in a fume hood. |
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| Company Name: |
DAVY CHEM LABS
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+91-9603460845 +91-9493444489 |
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www.davychemlabs.com |
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