CAS No.343926-69-2,2-Pyrimidinamine, 4-bromo- (9CI) Suppliers

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Basic Information

Molecular Structure:
CAS No.:	343926-69-2
Name:	2-Pyrimidinamine, 4-bromo- (9CI)

Formula:	C₄H₄BrN₃
Molecular Weight:	174
Synonyms:	2-Pyrimidinamine, 4-bromo- (9CI);
EINECS:	801-604-4
Density:	1.844 g/cm³
Melting Point:	>300 °C
Boiling Point:	340.7 °C at 760 mmHg
Flash Point:	159.9 °C
Solubility:	Slightly soluble in water.
Risk Codes:	22-36/37/38
Safety:	26-36/37-60
PSA:	51.80000
LogP:	1.40250

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Specification

The CAS register number of 2-Amino-4-bromopyrimidine is 343926-69-2. It also can be called as 2-Pyrimidinamine,4-bromo- and the systematic name about this chemical is 4-bromopyrimidin-2-amine. The molecular formula about this chemical is C₄H₄BrN₃and molecular weight is 174.00. It belongs to the following product categories, such as Pyrimidine; Pyridine; Organohalides and so on.

Physical properties about 2-Amino-4-bromopyrimidine are: (1)ACD/LogP: 0.76; (2)ACD/LogD (pH 5.5): 0.76; (3)ACD/LogD (pH 7.4): 0.76; (4)ACD/BCF (pH 5.5): 2.22; (5)ACD/BCF (pH 7.4): 2.23; (6)ACD/KOC (pH 5.5): 61.68; (7)ACD/KOC (pH 7.4): 61.7; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)Polar Surface Area: 51.8Å²; (11)Index of Refraction: 1.648; (12)Molar Refractivity: 34.36 cm³; (13)Molar Volume: 94.3 cm³; (14)Polarizability: 13.62x10^-24cm³; (15)Surface Tension: 68.9 dyne/cm; (16)Enthalpy of Vaporization: 58.43 kJ/mol; (17)Boiling Point: 340.7 °C at 760 mmHg; (18)Vapour Pressure: 8.43E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Brc1ccnc(N)n1
(2)InChI: InChI=1/C4H4BrN3/c5-3-1-2-7-4(6)8-3/h1-2H,(H2,6,7,8)
(3)InChIKey: MINURGGJJKMQQQ-UHFFFAOYAT
(4)Std. InChI: InChI=1S/C4H4BrN3/c5-3-1-2-7-4(6)8-3/h1-2H,(H2,6,7,8)
(5)Std. InChIKey: MINURGGJJKMQQQ-UHFFFAOYSA-N