Molecule structure of 4-Chlorothiophene-2-carboxylic acid (CAS NO.59614-95-8):
Systematic Name: 4-Chlorothiophene-2-carboxylic acid
Molecular Formula: C5H3ClO2S
Molecular Weight: 162.59 g/mol
CAS Registry Number: 59614-95-8
Index of Refraction: 1.623
Molar Refractivity: 36.46 cm3
Molar Volume: 103.3 cm3
Polarizability: 14.45×10-24 cm3
Surface Tension: 60.5 dyne/cm
Density: 1.572 g/cm3
Flash Point: 134 °C
Enthalpy of Vaporization: 56.8 kJ/mol
Boiling Point: 298 °C at 760 mmHg
Vapour Pressure: 0.000585 mmHg at 25 °C
SMILES: OC(=O)c1cc(Cl)cs1
InChI: InChI=1/C5H3ClO2S/c6-3-1-4(5(7)8)9-2-3/h1-2H,(H,7,8)
InChIKey: JWQMRBBWZUKWFJ-UHFFFAOYAS
Std. InChI: InChI=1S/C5H3ClO2S/c6-3-1-4(5(7)8)9-2-3/h1-2H,(H,7,8)
Std. InChIKey of 4-Chlorothiophene-2-carboxylic acid (CAS NO.59614-95-8): JWQMRBBWZUKWFJ-UHFFFAOYSA-N
4-Chlorothiophene-2-carboxylic acid (CAS NO.59614-95-8) is also named as 4-Chloro-2-thiophenecarboxylic acid .
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