CAS No.13534-99-1,3-Bromo-2-pyridinamine Suppliers,MSDS download

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Basic Information

Molecular Structure:
CAS No.:	13534-99-1
Name:	3-Bromo-2-pyridinamine
Article Data:	2

Formula:	C₅H₅BrN₂
Molecular Weight:	173.012
Synonyms:	5-Bomo-1H-pyridin-6-amine;3-Bromopyridin-2-amine;6,7-Dihydro-4H-Pyrano[4,3-d]thiazol-2-Yl-Amine;2-Amino-3-bromo pyridine;
EINECS:	-0
Density:	1.71 g/cm³
Melting Point:	63-67 °C
Boiling Point:	232 °C at 760 mmHg
Flash Point:	94.1 °C
Appearance:	grey to brown powder
Hazard Symbols:	Xi
Risk Codes:	36/37/38
Safety:	26-36
PSA:	38.91000
LogP:	2.00750

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Specification

The IUPAC name of 3-Bromo-2-pyridinamine is 3-bromopyridin-2-amine. With the CAS registry number 13534-99-1, it is also named as 2-Amino-3-bromopyridine. The product's categories are Pyridine; Pharmacetical; Pyridine Series; Pyridines; Boronic Acid; C5 Heterocyclic Building Blocks; Halogenated Heterocycles; Heterocyclic Building Blocks. Besides, it is grey to brown powder, which should be stored in closed, cool, dry and ventilated place at room temperature. In addition, its molecular formula is C₅H₅BrN₂ and molecular weight is 173.01.

The other characteristics of 3-Bromo-2-pyridinamine can be summarized as: (1)ACD/LogP: 2.13; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.11; (4)ACD/LogD (pH 7.4): 2.13; (5)ACD/BCF (pH 5.5): 23.36; (6)ACD/BCF (pH 7.4): 24.37; (7)ACD/KOC (pH 5.5): 328.04; (8)ACD/KOC (pH 7.4): 342.2; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 16.13 Å²; (13)Index of Refraction: 1.636; (14)Molar Refractivity: 36.27 cm³; (15)Molar Volume: 101.1 cm³; (16)Polarizability: 14.37×10^-24cm³; (17)Surface Tension: 56.9 dyne/cm; (18)Density: 1.71 g/cm³; (19)Flash Point: 94.1 °C; (20)Melting point: 63-67 °C; (21)Enthalpy of Vaporization: 46.87 kJ/mol; (22)Boiling Point: 232 °C at 760 mmHg; (23)Vapour Pressure: 0.0604 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following: it is irritating to eyes, respiratory system and skin. In case of contact with eyes, please rinse immediately with plenty of water and seek medical advice. Moreover, you should wear suitable protective clothing.

People can use the following data to convert to the molecule structure.
(1)SMILES: Brc1cccnc1N
(2)InChI: InChI=1/C5H5BrN2/c6-4-2-1-3-8-5(4)7/h1-3H,(H2,7,8)
(3)InChIKey: RBCARPJOEUEZLS-UHFFFAOYAM
(4)Std. InChI: InChI=1S/C5H5BrN2/c6-4-2-1-3-8-5(4)7/h1-3H,(H2,7,8)
(5)Std. InChIKey: RBCARPJOEUEZLS-UHFFFAOYSA-N