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CAS No.: | 6142-06-9 |
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Name: | N-Methyl-2-thiazolamine |
Article Data: | 8 |
Molecular Structure: | |
Formula: | C4H6N2S |
Molecular Weight: | 114.171 |
Synonyms: | N-Methyl-2-thiazolamine;N-Methyl-1,3-thiazol-2-amine;N-methyl-N-(1,3-thiazol-2-yl)amine; |
Density: | 1.246 g/cm3 |
Boiling Point: | 174.508 °C at 760 mmHg |
Flash Point: | 59.341 °C |
PSA: | 53.16000 |
LogP: | 1.25780 |
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This chemical is called 2-Thiazolamine, N-methyl-, and it can also be named as N-Methyl-2-thiazolamine. With the molecular formula of C4H6N2S, its molecular weight is 114.16884. The CAS registry number of this chemical is 6142-06-9. In addition, the systematic name of this chemical is N-methyl-1,3-thiazol-2-amine.
Other characteristics of the 2-Thiazolamine, N-methyl- can be summarised as follows: (1)ACD/LogP: 1.27; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0; (4)ACD/LogD (pH 7.4): 1; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 2; (7)ACD/KOC (pH 5.5): 14; (8)ACD/KOC (pH 7.4): 48; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 53.16 Å2; (13)Index of Refraction: 1.624; (14)Molar Refractivity: 32.338 cm3; (15)Molar Volume: 91.593 cm3; (16)Polarizability: 12.82×10-24 cm3; (17)Surface Tension: 49.929 dyne/cm; (18)Density: 1.246 g/cm3; (19)Flash Point: 59.341 °C; (20)Enthalpy of Vaporization: 41.085 kJ/mol; (21)Boiling Point: 174.508 °C at 760 mmHg; (22)Vapour Pressure: 1.202 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: n1ccsc1NC
2.InChI: InChI=1/C4H6N2S/c1-5-4-6-2-3-7-4/h2-3H,1H3,(H,5,6)
3.InChIKey: DWVCPSQPTSNMRX-UHFFFAOYAL