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17386-09-3

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Basic Information
CAS No.: 17386-09-3
Name: 4-(PYRROLIDIN-1-YLMETHYL)-1,3-THIAZOL-2-AMINE
Molecular Structure:
Molecular Structure of 17386-09-3 (4-(PYRROLIDIN-1-YLMETHYL)-1,3-THIAZOL-2-AMINE)
Formula: C8H13N3S
Molecular Weight: 183.277
Synonyms: Thiazole,2-amino-4-(1-pyrrolidinylmethyl)- (8CI);
Density: 1.281 g/cm3
Boiling Point: 314.1 °C at 760 mmHg
Flash Point: 143.8 °C
PSA: 71.12000
LogP: 1.18910
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Specification

The 2-Thiazolamine,4-(1-pyrrolidinylmethyl)- is an organic compound with the formula C8H13N3S. The systematic name of this chemical is 4-(Pyrrolidin-1-ylmethyl)-1,3-thiazol-2-amine. With the CAS registry number 17386-09-3, it is also named as 4-(1-Pyrrolidinylmethyl)-1,3-thiazol-2-ylamine. Besides, its molecular weight is 183.2739.

Physical properties about 2-Thiazolamine,4-(1-pyrrolidinylmethyl)- are: (1)ACD/LogP: 0.35; (2)ACD/LogD (pH 5.5): -2.27; (3)ACD/LogD (pH 7.4): -0.56; (4)ACD/BCF (pH 5.5): 1; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 1; (7)ACD/KOC (pH 7.4): 4.49; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 47.61 Å2; (12)Index of Refraction: 1.645; (13)Molar Refractivity: 51.89 cm3; (14)Molar Volume: 143 cm3; (15)Polarizability: 20.57×10-24 cm3; (16)Surface Tension: 66.9 dyne/cm; (17)Density: 1.281 g/cm3; (18)Flash Point: 143.8 °C; (19)Enthalpy of Vaporization: 55.52 kJ/mol; (20)Boiling Point: 314.1 °C at 760 mmHg; (21)Vapour Pressure: 0.000476 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C8H13N3S/c9-8-10-7(6-12-8)5-11-3-1-2-4-11/h6H,1-5H2,(H2,9,10)
(2)InChIKey: UYCNPLJANDOZKX-UHFFFAOYAL
(3)Std. InChI: InChI=1S/C8H13N3S/c9-8-10-7(6-12-8)5-11-3-1-2-4-11/h6H,1-5H2,(H2,9,10)
(4)Std. InChIKey: UYCNPLJANDOZKX-UHFFFAOYSA-N