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CAS No.: | 89250-34-0 |
---|---|
Name: | 3-(2-METHYL-1,3-THIAZOL-4-YL)ANILINE |
Article Data: | 7 |
Molecular Structure: | |
Formula: | C10H10N2S |
Molecular Weight: | 190.269 |
Synonyms: | 3-(2-Methyl-1,3-thiazol-4-yl)aniline;3-(2-Methylthiazol-4-yl)aniline;3-(2-Methylthiazol-4-yl)benzenamine;4-(3-Aminophenyl)-2-methylthiazole;[3-(2-Methylthiazol-4-yl)phenyl]amine; |
Density: | 1.219g/cm3 |
Melting Point: | 102-106 °C(lit.) |
Boiling Point: | 380.6 °C at 760 mmHg |
Flash Point: | 184 °C |
Hazard Symbols: | Xn; Xi |
Risk Codes: | 22-37/38-41 |
Safety: | 26-36/37/39 |
PSA: | 67.15000 |
LogP: | 3.28190 |
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The Benzenamine,3-(2-methyl-4-thiazolyl)-, with CAS registry number 89250-34-0, has the systematic name of 3-(2-methyl-1,3-thiazol-4-yl)aniline. Besides this, it is also called benzenamine, 3-(2-methyl-4-thiazolyl)-. And the chemical formula of this chemical is C10H10N2S.
Physical properties of Benzenamine,3-(2-methyl-4-thiazolyl)-: (1)ACD/LogP: 1.30; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 44.37 Å2; (7)Index of Refraction: 1.642; (8)Molar Refractivity: 56.38 cm3; (9)Molar Volume: 155.9 cm3; (10)Polarizability: 22.35×10-24cm3; (11)Surface Tension: 53.2 dyne/cm; (12)Enthalpy of Vaporization: 62.88 kJ/mol; (13)Vapour Pressure: 5.37E-06 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
The Benzenamine,3-(2-methyl-4-thiazolyl)- irritates to eyes, respiratory system and skin. This chemical is harmful if swallowed. And it also has risk of serious damage to the eyes. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: n2c(c1cc(N)ccc1)csc2C
(2)InChI: InChI=1/C10H10N2S/c1-7-12-10(6-13-7)8-3-2-4-9(11)5-8/h2-6H,11H2,1H3
(3)InChIKey: CPHZPWZSSBCSAH-UHFFFAOYAA
(4)Std. InChI: InChI=1S/C10H10N2S/c1-7-12-10(6-13-7)8-3-2-4-9(11)5-8/h2-6H,11H2,1H3
(5)Std. InChIKey: CPHZPWZSSBCSAH-UHFFFAOYSA-N