2-Bromopyrimidin-5-amine supplier

Name
2-Bromopyrimidin-5-amine
EINECS
CAS No. 56621-91-1
Article Data2
CAS DataBase
Density 1.844 g/cm³
Solubility
Melting Point 182-183 °C(Solv: benzene (71-43-2))
Formula C₄H₄BrN₃
Boiling Point 364.137 °C at 760 mmHg
Molecular Weight 173.9987
Flash Point 174.024 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 5-Amino-2-bromopyrimidine;5-pyrimidinamine, 2-bromo-;2-bromopyrimidine-5-ylamine;
PSA 51.80000
LogP 1.40250

2-Bromopyrimidin-5-amine Specification

The CAS register number of 2-Bromopyrimidin-5-amine is 56621-91-1. It also can be called as 5-pyrimidinamine, 2-bromo- and the systematic name about this chemical is 2-bromopyrimidin-5-amine. The molecular formula about this chemical is C₄H₄BrN₃ and the molecular weight is 173.9987.

Physical properties about 2-Bromopyrimidin-5-amine are: (1)ACD/LogP: 0.14; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 9; (5)ACD/KOC (pH 7.4): 9; (6)#H bond acceptors: 3; (7)#H bond donors: 2; (8)#Freely Rotating Bonds: 1; (9)Polar Surface Area: 51.8Å²; (10)Index of Refraction: 1.649; (11)Molar Refractivity: 34.362 cm³; (12)Molar Volume: 94.346 cm³; (13)Polarizability: 13.622x10^-24cm³; (14)Surface Tension: 68.982 dyne/cm; (15)Enthalpy of Vaporization: 61.028 kJ/mol; (16)Boiling Point: 364.137 °C at 760 mmHg.

You can still convert the following datas into molecular structure:
(1)SMILES: Nc1cnc(Br)nc1
(2)InChI: InChI=1/C4H4BrN3/c5-4-7-1-3(6)2-8-4/h1-2H,6H2
(3)InChIKey: BTXWPEMYVHUOPW-UHFFFAOYAY
(4)Std. InChI: InChI=1S/C4H4BrN3/c5-4-7-1-3(6)2-8-4/h1-2H,6H2
(5)Std. InChIKey: BTXWPEMYVHUOPW-UHFFFAOYSA-N

Product Name

2-Bromopyrimidin-5-amine

2-Bromopyrimidin-5-amine Specification

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