Name: 2-AMINO-4-(P-TOLYL)THIAZOLE
SKU: 2103-91-5

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Basic Information

Molecular Structure:
CAS No.:	2103-91-5
Name:	2-AMINO-4-(P-TOLYL)THIAZOLE
Article Data:	102

Formula:	C₁₀H₁₀N₂S
Molecular Weight:	190.269
Synonyms:	Thiazole,2-amino-4-p-tolyl- (6CI,7CI,8CI);2-Amino-4-(4-methylphenyl)thiazole;2-Amino-4-(p-methylphenyl)thiazole;2-Amino-4-p-tolylthiazole;4-(p-Tolyl)thiazol-2-amine;NSC 54436;
Density:	1.219 g/cm³
Melting Point:	132-136 °C(lit.)
Boiling Point:	369.4 °C at 760 mmHg
Flash Point:	177.2 °C
Hazard Symbols:	Xn, Xi
Risk Codes:	20/21/22
Safety:	26-36/37
PSA:	67.15000
LogP:	3.28190

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Specification

The 2-Thiazolamine,4-(4-methylphenyl)- is an organic compound with the formula C₁₀H₁₀N₂S. The IUPAC name of this chemical is 4-(4-Methylphenyl)-1,3-thiazol-2-amine. With the CAS registry number 2103-91-5, it is also named as 2(3H)-Thiazolimine, 4-(4-methylphenyl)-. The categories of the product are pharmacetical; Heterocyclic Compounds; Amines; Thiazoles, Isothiazoles and Benzothiazoles. Besides, it should be stored at in a cool, sealed, dry, well-ventilated place.

The physical properties of 2-Thiazolamine,4-(4-methylphenyl)- are: (1)ACD/LogP: 2.60; (2)ACD/LogD (pH 5.5): 2.31; (3)ACD/LogD (pH 7.4): 2.59; (4)ACD/BCF (pH 5.5): 28.78; (5)ACD/BCF (pH 7.4): 54.83; (6)ACD/KOC (pH 5.5): 319.9; (7)ACD/KOC (pH 7.4): 609.5; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 44.37 Å²; (12)Index of Refraction: 1.642; (13)Molar Refractivity: 56.38 cm³; (14)Molar Volume: 155.9 cm³; (15)Polarizability: 22.35×10^-24 cm³; (16)Surface Tension: 53.2 dyne/cm; (17)Density: 1.219 g/cm³; (18)Flash Point: 177.2 °C; (19)Enthalpy of Vaporization: 61.62 kJ/mol; (20)Boiling Point: 369.4 °C at 760 mmHg; (21)Vapour Pressure: 1.19E-05 mmHg at 25 °C.

Preparation: this chemical can be prepared by 1-p-Tolyl-ethanone and Thiourea. This reaction will need reagents N-bromosuccinimide and benzoyl peroxide and solvent benzene. The reaction time is 6 hours. The yield is about 69%.

2-Thiazolamine,4-(4-methylphenyl)- can be obtained by 1-p-Tolyl-ethanone and Thiourea

Uses of 2-Thiazolamine,4-(4-methylphenyl)-: it can be used to produce 2-[(4-p-Tolyl-thiazol-2-ylimino)-methyl]-phenol. It will need reagent piperidine and solvent ethanol.

2-Thiazolamine,4-(4-methylphenyl)- can be used to produce 2-[(4-p-Tolyl-thiazol-2-ylimino)-methyl]-phenol

When you are using this chemical, please be cautious about it as the following:
It is harmful by inhalation, in contact with skin and if swallowed. When you are using it, wear suitable protective clothing and gloves. In case of 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(c1ccc(cc1)C)csc2N
(2)InChI: InChI=1/C10H10N2S/c1-7-2-4-8(5-3-7)9-6-13-10(11)12-9/h2-6H,1H3,(H2,11,12)
(3)InChIKey: ARLHWYFAPHJCJT-UHFFFAOYAG
(4)Std. InChI: InChI=1S/C10H10N2S/c1-7-2-4-8(5-3-7)9-6-13-10(11)12-9/h2-6H,1H3,(H2,11,12)
(5)Std. InChIKey: ARLHWYFAPHJCJT-UHFFFAOYSA-N