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Cas Database |
| Name |
2-Chloro-1,3-thiazole-5-carboxaldehyde |
EINECS | N/A |
| CAS No. | 95453-58-0 | Density | 1.541g/cm3 |
| PSA | 58.20000 | LogP | 1.60900 |
| Solubility | N/A | Melting Point |
85-88°C |
| Formula | C4H2ClNOS | Boiling Point | 278.6 °C at 760 mmHg |
| Molecular Weight | 147.585 | Flash Point | 122.3 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | 36/37 | Risk Codes | 43 |
| Molecular Structure |
|
Hazard Symbols | N/A |
| Synonyms |
2-Chloro-1,3-thiazole-5-carboxaldehyde;2-Chlorothiazole-5-carboxaldehyde; |
Article Data | 3 |
2-Chloro-1,3-thiazole-5-carboxaldehyde Specification
The 2-Chloro-1,3-thiazole-5-carboxaldehyde ,its cas register number is 95453-58-0.It also can be called as 5-Thiazolecarboxaldehyde,2-chloro- and the IUPAC name about this chemical is 2-Chloro-1,3-thiazole-5-carbaldehyde .It belongs to the following product categories, such as Aldehyde, Building Blocks, Thiazole and so on.HazardClass about this chemical is Irritant. It can be used as pharmaceutical intermediates.
Following are the chemical properties about 2-Chloro-1,3-thiazole-5-carboxaldehyde :(1)#H bond acceptors: 2 ; (2)#H bond donors: 0 ; (3)#Freely Rotating Bonds: 1; (4) Polar Surface Area: 58.2 Å2 ; (5)Index of Refraction: 1.637 ; (6)Molar Refractivity: 34.37 cm3 ; (7)Molar Volume: 95.7 cm3 ; (8)Polarizability: 13.62x10-24cm3 ; (9)Surface Tension: 59.1 dyne/cm ; (10)Enthalpy of Vaporization: 51.73 kJ/mol ; (11)Vapour Pressure: 0.00421 mmHg at 25°C
This chemical can be described computed from structure:
(1)Canonical SMILES: C1=C(SC(=N1)Cl)C=O
(2)InChI: InChI=1S/C4H2ClNOS/c5-4-6-1-3(2-7)8-4/h1-2H
(3)InChIKey: PKCBQQXHFIDIIG-UHFFFAOYSA-N
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