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CAS No.: | 50508-57-1 |
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Name: | 2-Amino-3-chlorobenzoyl-5-methylthiophene |
Molecular Structure: | |
Formula: | C12H10ClNOS |
Molecular Weight: | 251.02 |
Synonyms: | LogP |
Density: | 1.342 g/cm3 |
Boiling Point: | 449 °C at 760 mmHg |
Flash Point: | 225.4 °C |
PSA: | 71.33000 |
LogP: | 4.10430 |
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The CAS registry number of Methanone, (2-amino-5-methyl-3-thienyl)(2-chlorophenyl)- is 50508-57-1. In addition, the molecular formula is C12H10ClNOS and the molecular weight is 251.02. The systematic name is (2-amino-5-methyl-3-thienyl)-(2-chlorophenyl)methanone. What's more, it should be stored in sealed container, and put in a cool and dry place.
Physical properties about Methanone, (2-amino-5-methyl-3-thienyl)(2-chlorophenyl)- are: (1)ACD/LogP: 2.81; (2)ACD/LogD (pH 5.5): 2.81; (3)ACD/LogD (pH 7.4): 2.81; (4)#H bond acceptors: 2; (5)#H bond donors: 2; (6)#Freely Rotating Bonds: 3; (7)Polar Surface Area: 71.33 Å2; (8)Index of Refraction: 1.649; (9)Molar Refractivity: 68.38 cm3; (10)Molar Volume: 187.5 cm3; (11)Polarizability: 27.11 ×10-24cm3; (12)Surface Tension: 54.4 dyne/cm; (13)Density: 1.342 g/cm3; (14)Flash Point: 225.4 °C; (15)Enthalpy of Vaporization: 70.77 kJ/mol; (16)Boiling Point: 449 °C at 760 mmHg; (17)Vapour Pressure: 2.95E-08 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Cc2cc(C(=O)c1ccccc1Cl)c(N)s2
(2)Std.InChI: InChI=1S/C12H10ClNOS/c1-7-6-9(12(14)16-7)11(15)8-4-2-3-5-10(8)13/h2-6H,14H2,1H3
(3)Std.InChIKey: OFXVJJAAUSIJII-UHFFFAOYSA-N