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CAS No.: | 27685-94-5 |
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Name: | 4-Chlorothieno[3,2-c]pyridine |
Article Data: | 10 |
Molecular Structure: | |
Formula: | C7H4ClNS |
Molecular Weight: | 169.634 |
Synonyms: | 4-Chlorothieno[3,2-c]pyridine; |
Density: | 1.435 g/cm3 |
Melting Point: | 97-100 °C |
Boiling Point: | 296.5 °C at 760 mmHg |
Flash Point: | 133.118 °C |
Hazard Symbols: | Xi |
Risk Codes: | 25-36 |
Safety: | 26-45 |
PSA: | 41.13000 |
LogP: | 2.94970 |
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The 4-Chlorothieno[3,2-c]pyridine, with the CAS registry number 27685-94-5, is also known as ZINC02386297. It belongs to the product categories of Halides; API intermediates; Pyridine; Fused Ring Systems. This chemical's molecular formula is C7H4ClNS and molecular weight is 169.63. Its IUPAC name is called 4-chlorothieno[3,2-c]pyridine. When you are using this chemical, please be cautious about it. This chemical may cause inflammation to the skin or other mucous membranes. The product should be sealed and stored in cool and dry place.
Physical properties of 4-Chlorothieno[3,2-c]pyridine: (1)ACD/LogP: 2.60; (2)ACD/LogD (pH 5.5): 3; (3)ACD/LogD (pH 7.4): 3; (4)ACD/BCF (pH 5.5): 56; (5)ACD/BCF (pH 7.4): 56; (6)ACD/KOC (pH 5.5): 620; (7)ACD/KOC (pH 7.4): 620; (8)#H bond acceptors: 1; (9)Index of Refraction: 1.696; (10)Molar Refractivity: 45.466 cm3; (11)Molar Volume: 118.203 cm3; (12)Surface Tension: 56.648 dyne/cm; (13)Density: 1.435 g/cm3; (14)Flash Point: 133.118 °C; (15)Enthalpy of Vaporization: 51.482 kJ/mol; (16)Boiling Point: 296.5 °C at 760 mmHg; (17)Vapour Pressure: 0.003 mmHg at 25°C.
Preparation: this chemical can be prepared by 5H-thieno[3,2-c]pyridin-4-one. This reaction will need reagent POCl3. The reaction time is 2.5 hours. The yield is about 85%.
Uses of 4-Chlorothieno[3,2-c]pyridine: it can be used to produce 4-(1-πperazinyl)thieno[3,2-c]pyridine at temperature of 120 °C. The yield is about 54%.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CN=C(C2=C1SC=C2)Cl
(2)InChI: InChI=1S/C7H4ClNS/c8-7-5-2-4-10-6(5)1-3-9-7/h1-4H
(3)InChIKey: VFPFMOXMHVQFNR-UHFFFAOYSA-N