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129053-68-5

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Basic Information
CAS No.: 129053-68-5
Name: 2-Chloro-5-methyloxazole
Molecular Structure:
Molecular Structure of 129053-68-5 (2-Chloro-5-methyloxazole)
Formula: C4H4ClNO
Molecular Weight: 117.5337
Synonyms: 2-CHLORO-5-METHYLOXAZOLE
Density: 1.254 g/cm3
Boiling Point: 166.8 °C at 760 mmHg
Flash Point: 54.7 °C
PSA: 26.03000
LogP: 1.63640
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Specification

The 2-Chloro-5-methyloxazole is an organic compound with the formula C4H4ClNO. The systematic name of this chemical is 2-Chloro-5-methyl-1,3-oxazole. The CAS registry number of this chemical is 129053-68-5. Besides, its molecular weight is 117.5337.

Physical properties about 2-Chloro-5-methyloxazole are: (1)ACD/LogP: 1.64; (2)ACD/LogD (pH 5.5): 1.64; (3)ACD/LogD (pH 7.4): 1.64; (4)ACD/BCF (pH 5.5): 10.36; (5)ACD/BCF (pH 7.4): 10.36; (6)ACD/KOC (pH 5.5): 185.56; (7)ACD/KOC (pH 7.4): 185.56; (8)#H bond acceptors: 2; (9)Polar Surface Area: 26.03 Å2; (10)Index of Refraction: 1.474; (11)Molar Refractivity: 26.36 cm3; (12)Molar Volume: 93.6 cm3; (13)Polarizability: 10.45×10-24 cm3; (14)Surface Tension: 35.6 dyne/cm; (15)Density: 1.254 g/cm3; (16)Flash Point: 54.7 °C; (17)Enthalpy of Vaporization: 38.67 kJ/mol; (18)Boiling Point: 166.8 °C at 760 mmHg; (19)Vapour Pressure: 2.31 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C4H4ClNO/c1-3-2-6-4(5)7-3/h2H,1H3
(2)InChIKey: CBCCZOGCQCTMGJ-UHFFFAOYAZ
(3)Std. InChI: InChI=1S/C4H4ClNO/c1-3-2-6-4(5)7-3/h2H,1H3
(4)Std. InChIKey: CBCCZOGCQCTMGJ-UHFFFAOYSA-N