3-chloro-4-(chloromethyl)-5-hydroxy-2(5H)-furanone

IUPAC Name: 4-chloro-3-(chloromethyl)-2-hydroxy-2H-furan-5-one
Synonyms of 3-Chloro-4-(chloromethyl)-5-hydroxy-2(5H)-furanone (CAS NO.125974-08-5): CCRIS 5336 ;  2(5H)-Furanone, 3-chloro-4-(chloromethyl)-5-hydroxy-
CAS NO: 125974-08-5
Molecular Formula of 3-Chloro-4-(chloromethyl)-5-hydroxy-2(5H)-furanone (CAS NO.125974-08-5): C₅H₄Cl₂O₃
Molecular Weight: 182.9895
Molecular Structure:

H bond acceptors: 3
H bond donors: 1
Freely Rotating Bonds: 2
Polar Surface Area: 35.53 Å²
Index of Refraction: 1.556
Molar Refractivity: 35.63 cm³
Molar Volume: 110.7 cm³
Surface Tension: 53.2 dyne/cm
Density of 3-Chloro-4-(chloromethyl)-5-hydroxy-2(5H)-furanone (CAS NO.125974-08-5): 1.65 g/cm³
Flash Point: 195.4 °C
Enthalpy of Vaporization: 75.16 kJ/mol
Boiling Point: 399.5 °C at 760 mmHg
Vapour Pressure: 4.83E-08 mmHg at 25°C

Mutation data
Test type: Mutation in microorganismsTEST SYSTEM : Bacteria - Salmonella typhimurium
Dose / time: 500 pg/plate
Reference: CRTOEC Chemical Research in Toxicology. (American Chemical Soc., Distribution Office Dept. 223, POB 57/36, West End Station, Washington, DC 20037) V.1- 1988- Volume(issue)/page/year: 4,35,1991
Test type: Mutation in microorganismsTEST SYSTEM : Bacteria - Salmonella typhimurium
Dose / time: 200 ng/plate
Reference: MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 348,51,1995
Test type: DNA repairTEST SYSTEM : Bacteria - Escherichia coli
Dose / time: 120 ug/L
Reference: EMMUEG Environmental and Molecular Mutagenesis. (Alan R. Liss, Inc., 41 E. 11th St., New York, NY 10003) V.10- 1987- Volume(issue)/page/year: 24,317,1994
Test type: Host-mediated assayTEST SYSTEM : Rodent - mouse Bacteria - Escherichia coli
Dose / time: 200 mg/kg
Reference: EMMUEG Environmental and Molecular Mutagenesis. (Alan R. Liss, Inc., 41 E. 11th St., New York, NY 10003) V.10- 1987- Volume(issue)/page/year: 24,317,1994
Test type: Mutation in mammalian somatic cellsTEST SYSTEM : Rodent - hamster Ovary
Dose / time: 8 mg/L
Reference: MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 348,51,1995

Mutation data reported. When heated to decomposition it emits toxic vapors of NO_x and Cl⁻.