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25021-49-2

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Basic Information
CAS No.: 25021-49-2
Name: 4-(2-METHYL-1,3-THIAZOL-4-YL)ANILINE
Article Data: 11
Molecular Structure:
Molecular Structure of 25021-49-2 (4-(2-METHYL-1,3-THIAZOL-4-YL)ANILINE)
Formula: C10H10N2S
Molecular Weight: 190.269
Synonyms: Thiazole,4-(p-aminophenyl)-2-methyl- (8CI);4-(2-Methylthiazol-4-yl)aniline;4-(2-Methylthiazol-4-yl)phenylamine;2-Methyl-4-(para-aminophenyl)thiazole;
Density: 1.219 g/cm3
Melting Point: 133-135 °C(Solv: water (7732-18-5); ethanol (64-17-5))
Boiling Point: 346.1 °C at 760 mmHg
Flash Point: 163.1 °C
Hazard Symbols: IrritantXi
Risk Codes: 41
Safety: 26-39
PSA: 67.15000
LogP: 3.28190
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Specification

The Benzenamine,4-(2-methyl-4-thiazolyl)-, with the CAS registry number 25021-49-2, is also known as 4-(2-Methylthiazol-4-yl)phenylamine. This chemical's molecular formula is C10H10N2S and molecular weight is 190.26. What's more, its systematic name is 4-(2-methyl-1,3-thiazol-4-yl)aniline.

Physical properties of Benzenamine,4-(2-methyl-4-thiazolyl)- are: (1)ACD/LogP: 1.65; (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)Density: 1.219 g/cm3; (13)Flash Point: 163.1 °C; (14)Enthalpy of Vaporization: 59.03 kJ/mol; (15)Boiling Point: 346.1 °C at 760 mmHg; (16)Vapour Pressure: 5.88E-05 mmHg at 25°C.

Preparation: this chemical can be prepared by 2-methyl-4-(4-nitro-phenyl)-thiazole at the temperature of 20 °C. This reaction will need reagent H2 and solvent ethanol. This reaction will also need catalyst 10% Pd/C. The yield is about 86%.

Benzenamine,4-(2-methyl-4-thiazolyl)- can be prepared by 2-methyl-4-(4-nitro-phenyl)-thiazole at the temperature of 20 °C

Uses of Benzenamine,4-(2-methyl-4-thiazolyl)-: it can be used to produce [4-(2-methyl-thiazol-4-yl)-phenyl]-carbamic acid phenyl ester at the temperature of 0 °C. It will need reagent pyridine and solvent CH2Cl2 with the reaction time of 30 min. The yield is about 94%.

Benzenamine,4-(2-methyl-4-thiazolyl)- can be used to produce [4-(2-methyl-thiazol-4-yl)-phenyl]-carbamic acid phenyl ester at the temperature of 0 °C

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=NC(=CS1)C2=CC=C(C=C2)N
(2)InChI: InChI=1S/C10H10N2S/c1-7-12-10(6-13-7)8-2-4-9(11)5-3-8/h2-6H,11H2,1H3
(3)InChIKey: JCRKEVDAEUPNAA-UHFFFAOYSA-N