4-Bromo-thiazol-2-ylamine supplier

Name
4-Bromo-thiazol-2-ylamine
EINECS
CAS No. 502145-18-8
Density 1.976 g/cm³
Solubility
Melting Point
Formula C₃H₃BrN₂S
Boiling Point 287.6 °C at 760 mmHg
Molecular Weight 179.04
Flash Point 127.7 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2-Amino-4-bromothiazole;2-Thiazolamine, 4-bromo-;4-bromo-1,3-thiazol-2-amine;2-Amino-4-bromothiazole;
PSA 67.15000
LogP 2.06900

4-Bromo-thiazol-2-ylamine Specification

The 4-Bromo-thiazol-2-ylamine, with the CAS registry number 502145-18-8, has the systematic name of 4-bromo-1,3-thiazol-2-amine. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C₃H₃BrN₂S.

The characteristics of 4-Bromo-thiazol-2-ylamine are as followings: (1)ACD/LogP: 1.15; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.14; (4)ACD/LogD (pH 7.4): 1.15; (5)ACD/BCF (pH 5.5): 4.32; (6)ACD/BCF (pH 7.4): 4.42; (7)ACD/KOC (pH 5.5): 98.62; (8)ACD/KOC (pH 7.4): 100.79; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 44.37 Å²; (13)Index of Refraction: 1.69; (14)Molar Refractivity: 34.65 cm³; (15)Molar Volume: 90.6 cm³; (16)Polarizability: 13.73×10^-24cm³; (17)Surface Tension: 68.7 dyne/cm; (18)Density: 1.976 g/cm³; (19)Flash Point: 127.7 °C; (20)Enthalpy of Vaporization: 52.68 kJ/mol; (21)Boiling Point: 287.6 °C at 760 mmHg; (22)Vapour Pressure: 0.00246 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Brc1nc(sc1)N
(2)InChI: InChI=1/C3H3BrN2S/c4-2-1-7-3(5)6-2/h1H,(H2,5,6)
(3)InChIKey: QJPQUNWGOHADOB-UHFFFAOYAX

Product Name

4-Bromo-thiazol-2-ylamine

4-Bromo-thiazol-2-ylamine Specification

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