2-Thiazolamine,4-(chloromethyl)-N-phenyl- supplier

Name
(4-CHLOROMETHYL-THIAZOL-2-YL)-PHENYL-AMINE
EINECS
CAS No. 35199-21-4
Density 1.354 g/cm³
Solubility
Melting Point
Formula C₁₀H₉ClN₂S
Boiling Point 367 °C at 760 mmHg
Molecular Weight 224.7099
Flash Point 175.7 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Thiazole,2-anilino-4-(chloromethyl)- (7CI);2-Anilino-4-(chloromethyl)thiazole;
PSA 56.39000
LogP 3.04740

2-Thiazolamine,4-(chloromethyl)-N-phenyl- Specification

The 2-Thiazolamine,4-(chloromethyl)-N-phenyl- is an organic compound with the formula C₁₀H₉ClN₂S. The IUPAC name of this chemical is 4-(Chloromethyl)-N-phenyl-1,3-thiazol-2-amine. With the CAS registry number 35199-21-4, it is also named as (4-Chloromethyl-thiazol-2-yl)-phenyl-amine. Besides, its molecular weight is 224.7099.

The physical properties of 2-Thiazolamine,4-(chloromethyl)-N-phenyl- are: (1)ACD/LogP: 2.60; (2)ACD/LogD (pH 5.5): 2.57; (3)ACD/LogD (pH 7.4): 2.6; (4)ACD/BCF (pH 5.5): 51.96; (5)ACD/BCF (pH 7.4): 55.34; (6)ACD/KOC (pH 5.5): 577.86; (7)ACD/KOC (pH 7.4): 615.4; (8)#H bond acceptors: 2; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 44.37 Å²; (12)Index of Refraction: 1.668; (13)Molar Refractivity: 61.86 cm³; (14)Molar Volume: 165.8 cm³; (15)Polarizability: 24.52×10^-24 cm³; (16)Surface Tension: 55.7 dyne/cm; (17)Density: 1.354 g/cm³; (18)Flash Point: 175.7 °C; (19)Enthalpy of Vaporization: 61.34 kJ/mol; (20)Boiling Point: 367 °C at 760 mmHg; (21)Vapour Pressure: 1.41E-05 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: ClCc1nc(sc1)Nc2ccccc2
(2)InChI: InChI=1/C10H9ClN2S/c11-6-9-7-14-10(13-9)12-8-4-2-1-3-5-8/h1-5,7H,6H2,(H,12,13)
(3)InChIKey: MTTZCPPLWMZEJL-UHFFFAOYAW
(4)Std. InChI: InChI=1S/C10H9ClN2S/c11-6-9-7-14-10(13-9)12-8-4-2-1-3-5-8/h1-5,7H,6H2,(H,12,13)
(5)Std. InChIKey: MTTZCPPLWMZEJL-UHFFFAOYSA-N

Product Name

(4-CHLOROMETHYL-THIAZOL-2-YL)-PHENYL-AMINE

2-Thiazolamine,4-(chloromethyl)-N-phenyl- Specification

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