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CAS No.: | 15854-08-7 |
---|---|
Name: | ETHYL 2-AMINO-4-(4-METHYLPHENYL)-3-THIOPHENECARBOXYLATE |
Article Data: | 8 |
Molecular Structure: | |
Formula: | C14H15NO2S |
Molecular Weight: | 261.345 |
Synonyms: | 3-Thiophenecarboxylicacid, 2-amino-4-p-tolyl-, ethyl ester (8CI); |
Density: | 1.203 g/cm3 |
Melting Point: | 105-107℃ |
Boiling Point: | 401.5 °C at 760 mmHg |
Flash Point: | 196.6 °C |
Hazard Symbols: | Xi |
Risk Codes: | Xi:; "> Xi:; |
Safety: | 24/25 |
PSA: | 80.56000 |
LogP: | 4.06360 |
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The 3-Thiophenecarboxylicacid, 2-amino-4-(4-methylphenyl)-, ethyl ester is an organic compound with the formula C14H15NO2S. The IUPAC name of this chemical is Ethyl 2-amino-4-(4-methylphenyl)thiophene-3-carboxylate. With the CAS registry number 15854-08-7, it is also named as 2-Amino-3-(ethoxycarbonyl)-4-(4-methylphenyl)thiophene. Besides, its molecular weight is 261.34.
Physical properties about 3-Thiophenecarboxylicacid, 2-amino-4-(4-methylphenyl)-, ethyl ester are: (1)ACD/LogP: 3.60; (2)#H bond acceptors: 3; (3)#H bond donors: 2; (4)#Freely Rotating Bonds: 5; (5)Polar Surface Area: 57.78 Å2; (6)Index of Refraction: 1.604; (7)Molar Refractivity: 74.69 cm3; (8)Molar Volume: 217.1 cm3; (9)Polarizability: 29.61×10-24 cm3; (10)Surface Tension: 48.1 dyne/cm; (11)Density: 1.203 g/cm3; (12)Flash Point: 196.6 °C; (13)Enthalpy of Vaporization: 65.25 kJ/mol; (14)Boiling Point: 401.5 °C at 760 mmHg; (15)Vapour Pressure: 1.18E-06 mmHg at 25 °C.
When you are using this chemical, please be cautious about it as the following:
When you are using it, avoid contact with skin and eyes.
You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C14H15NO2S/c1-3-17-14(16)12-11(8-18-13(12)15)10-6-4-9(2)5-7-10/h4-8H,3,15H2,1-2H3
(2)InChIKey: GOQSMGNEJVWZIG-UHFFFAOYAF
(3)Std. InChI: InChI=1S/C14H15NO2S/c1-3-17-14(16)12-11(8-18-13(12)15)10-6-4-9(2)5-7-10/h4-8H,3,15H2,1-2H3
(4)Std. InChIKey: GOQSMGNEJVWZIG-UHFFFAOYSA-N