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Cas Database |
| Name |
2,5-Dichlorothiophene-3-carbaldehyde |
EINECS | N/A |
| CAS No. | 61200-60-0 | Density | 1.581 g/cm3 |
| PSA | 45.31000 | LogP | 2.86740 |
| Solubility | N/A | Melting Point |
24.0-24.5 °C |
| Formula | C5H2Cl2OS | Boiling Point | 229.8 °C at 760 mmHg |
| Molecular Weight | 181.042 | Flash Point | 92.8 °C |
| Transport Information | N/A | Appearance | N/A |
| Safety | Risk Codes |
 Xn:Harmful; |
|
| Molecular Structure |
|
Hazard Symbols | R20/21/22:Harmful by inhalation, in contact with skin and if swallowed.; R36/37/38:Irritating to eyes, respiratory system |
| Synonyms |
2,5-Dichlorothiophene-3-carbaldehyde;2,5-DICHLOROTHIOPHENE-3-CARBALDEHYDE, 97;3-Thiophenecarboxaldehyde, 2,5-dichloro-;2,5-Dichloro-3-formylthiophene |
Article Data | 8 |
2,5-Dichlorothiophene-3-carbaldehyde Specification
The 2,5-Dichlorothiophene-3-carbaldehyde, with the CAS registry number 61200-60-0, is also known as 2,5-Dichloro-3-thiophenecarbaldehyde. This chemical's molecular formula is C5H2Cl2OS and molecular weight is 181.0398. Its systematic name is called 2,5-dichlorothiophene-3-carbaldehyde.
Physical properties of 2,5-Dichlorothiophene-3-carbaldehyde: (1)ACD/LogP: 2.43; (2)ACD/LogD (pH 5.5): 2.43; (3)ACD/LogD (pH 7.4): 2.43; (4)ACD/BCF (pH 5.5): 41.06; (5)ACD/BCF (pH 7.4): 41.06; (6)ACD/KOC (pH 5.5): 497.12; (7)ACD/KOC (pH 7.4): 497.12; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 1; (10)Index of Refraction: 1.638; (11)Molar Refractivity: 41.18 cm3; (12)Molar Volume: 114.4 cm3; (13)Surface Tension: 51.8 dyne/cm; (14)Density: 1.581 g/cm3; (15)Flash Point: 92.8 °C; (16)Enthalpy of Vaporization: 46.64 kJ/mol; (17)Boiling Point: 229.8 °C at 760 mmHg; (18)Vapour Pressure: 0.0683 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc1sc(Cl)c(C=O)c1
(2)InChI: InChI=1/C5H2Cl2OS/c6-4-1-3(2-8)5(7)9-4/h1-2H
(3)InChIKey: PTHQASYUHZFSKR-UHFFFAOYAY
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