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3-Amino-5-bromopyridine

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Name

3-Amino-5-bromopyridine

EINECS 629-312-0
CAS No. 13535-01-8 Density 1.71 g/cm3
PSA 38.91000 LogP 2.00750
Solubility N/A Melting Point 65-69 ºC
Formula C5H5BrN2 Boiling Point 287.6 ºC at 760mmHg
Molecular Weight 173.012 Flash Point 127.7 ºC
Transport Information N/A Appearance Light yellow crystal
Safety 26-36/37 Risk Codes 22-36/37/38
Molecular Structure Molecular Structure of 13535-01-8 (3-Amino-5-bromopyridine) Hazard Symbols HarmfulXn,IrritantXi,OxidizingO
Synonyms

5-bromopyridin-3-amine;3-Amino-5-Bromo Pyridine;

Article Data 23

3-Amino-5-bromopyridine Specification

1.Introduction of 3-Amino-5-bromopyridine

The IUPAC name of 3-Amino-5-bromopyridine is 5-bromopyridin-3-amine. With the CAS registry number 13535-01-8, it is also named as 3-Pyridinamine, 5-bromo-. The product's categories are blocks; bromides; pyridines, pyrimidines, purines and pteredines; pharmacetical; amines; pyridine derivertives; chiral chemicals; boronic acid. It is light yellow crystal which can be used in organic synthesis. Additionally, this chemical can be produced from 3,5-dibromo-pyridine by aminolysis.

2.Properties of 3-Amino-5-bromopyridine

(1)ACD/LogP: 1.04; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.031; (4)ACD/LogD (pH 7.4): 1.039; (5)ACD/BCF (pH 5.5): 3.557; (6)ACD/BCF (pH 7.4): 3.629; (7)ACD/KOC (pH 5.5): 85.828; (8)ACD/KOC (pH 7.4): 87.552; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Index of Refraction: 1.636; (13)Molar Refractivity: 36.27 cm3; (14)Molar Volume: 101.122 cm3; (15)Polarizability: 14.379×10-24 cm3; (16)Surface Tension: 56.917 dyne/cm; (17)Enthalpy of Vaporization: 52.679 kJ/mol; (18)Vapour Pressure: 0.002 mmHg at 25°C; (19)Exact Mass: 171.963611; (20)MonoIsotopic Mass: 171.963611; (21)Topological Polar Surface Area: 38.9; (22)Heavy Atom Count: 8; (23)Complexity: 76.8.

3.Structure descriptors of 3-Amino-5-bromopyridine

SMILES:c1c(cncc1Br)N
InChI:InChI=1/C5H5BrN2/c6-4-1-5(7)3-8-2-4/h1-3H,7H2 
InChIKey:MDQXGHBCDCOOSM-UHFFFAOYAI

4.Safety information of 3-Amino-5-bromopyridine

It is not only harmful if swallowed, but also irritating to eyes, respiratory system and skin. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. If you want to contact this product, you must wear suitable protective clothing and gloves.

 

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