CAS No.121519-00-4,5-BROMO-2-(TERT-BUTYLDIMETHYLSILYLOXY)PYRIMIDINE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	121519-00-4
Name:	5-BROMO-2-(TERT-BUTYLDIMETHYLSILYLOXY)PYRIMIDINE
Article Data:	1

Formula:	C₁₀H₁₇BrN₂OSi
Molecular Weight:	289.247
Synonyms:	5-bromo-2-{[tert-butyl(dimethyl)silyl]oxy}pyrimidine;5-Bromo-2-[[(1,1-dimethylethyl)dimethylsilyl]oxy]pyrimidine;5-Brom-2-{[tert-butyl(dimethyl)silyl]oxy}pyrimidin;5-Bromo-2-(tert-butyldimethylsilyl)pyrimidine;5-Bromo-2-(tert-butyldimethylsilyloxy)pyrimidine;pyrimidine, 5-bromo-2-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-;
Density:	1.234 g/cm³
Boiling Point:	296.2 °C at 760 mmHg
Flash Point:	132.9 °C
Hazard Symbols:	Xi; Xn
Risk Codes:	36/37/38
Safety:	26-36
PSA:	35.01000
LogP:	3.62310

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Specification

The Pyrimidine,5-bromo-2-[[(1,1-dimethylethyl)dimethylsilyl]oxy]-, with the CAS registry number 121519-00-4, has the systematic name of 5-bromo-2-{[tert-butyl(dimethyl)silyl]oxy}pyrimidine. It belongs to the following product categories: Pyrimidine; Heterocyclic Compounds; Halogenated; Organohalides; PyrimidinesHeterocyclic Building Blocks; Building Blocks; Halogenated Heterocycles; Heterocyclic Building Blocks; Pyrimidines. And the molecular formula of the chemical is C₁₀H₁₇BrN₂OSi.

The characteristics of Pyrimidine,5-bromo-2-[[(1,1-dimethylethyl)dimethylsilyl]oxy]- are as followings: (1)ACD/LogP: 3.49; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.48; (4)ACD/LogD (pH 7.4): 3.48; (5)ACD/BCF (pH 5.5): 262.12; (6)ACD/BCF (pH 7.4): 262.12; (7)ACD/KOC (pH 5.5): 1874; (8)ACD/KOC (pH 7.4): 1874.01; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 35.01 Å²; (13)Index of Refraction: 1.497; (14)Molar Refractivity: 68.65 cm³; (15)Molar Volume: 234.3 cm³; (16)Polarizability: 27.21×10^-24cm³; (17)Surface Tension: 31.6 dyne/cm; (18)Density: 1.234 g/cm³; (19)Flash Point: 132.9 °C; (20)Enthalpy of Vaporization: 51.45 kJ/mol; (21)Boiling Point: 296.2 °C at 760 mmHg; (22)Vapour Pressure: 0.00257 mmHg at 25°C.

You should be cautious while dealing with this chemical. It irritates to eyes, respiratory system and skin. Therefore, you had better take the following instructions: Wear suitable protective clothing, and if in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Brc1cnc(O[Si](C)(C(C)(C)C)C)nc1
(2)InChI: InChI=1/C10H17BrN2OSi/c1-10(2,3)15(4,5)14-9-12-6-8(11)7-13-9/h6-7H,1-5H3
(3)InChIKey: GCALLZMACFTOPD-UHFFFAOYAA