3-Chlorothiophene-2-carbaldehyde supplier

Name
3-CHLOROTHIOPHENE-2-CARBALDEHYDE
EINECS
CAS No. 67482-48-8
Article Data4
CAS DataBase
Density 1.429
Solubility
Melting Point
Formula C₅H₃ClOS
Boiling Point 230 °C at 760 mmHg
Molecular Weight 146.597
Flash Point 92.9 °C
Transport Information
Appearance
Safety 23-2636/37/39
Risk Codes 20/21/22-36/37/38
Molecular Structure
Hazard Symbols
Synonyms 3-Chlorothiophene-2-carboxaldehyde;3-Chlorothiophene-2-carbaldehyde;
PSA 45.31000
LogP 2.21400

3-Chlorothiophene-2-carbaldehyde Specification

The 3-Chlorothiophene-2-carbaldehyde is a chemical compound with formula C₅H₃ClOS. Its cas registry number is 67482-48-8. Both its systematic name and IUPAC name are the same which is called 3-chlorothiophene-2-carbaldehyde.

The physical properties about this chemical are: (1)ACD/LogP: 1.77; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.77; (4)ACD/LogD (pH 7.4): 1.77; (5)ACD/BCF (pH 5.5): 13.02; (6)ACD/BCF (pH 7.4): 13.02; (7)ACD/KOC (pH 5.5): 218.45; (8)ACD/KOC (pH 7.4): 218.45; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Index of Refraction: 1.625; (13)Molar Refractivity: 36.28 cm³; (14)Molar Volume: 102.5 cm³; (15)Surface Tension: 49 dyne/cm; (16)Density: 1.429 g/cm³; (17)Flash Point: 92.9 °C; (18)Enthalpy of Vaporization: 46.66 kJ/mol; (19)Boiling Point: 230 °C at 760 mmHg; (20)Vapour Pressure: 0.0674 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=Cc1sccc1Cl;
(2)InChI: InChI=1/C5H3ClOS/c6-4-1-2-8-5(4)3-7/h1-3H;
(3)InChIKey: PJOJWMNHMJFFCR-UHFFFAOYAK

Product Name

3-CHLOROTHIOPHENE-2-CARBALDEHYDE

3-Chlorothiophene-2-carbaldehyde Specification

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