Related Searches: 3-Amino-6-bromopyridine, 2-Amino-6-bromopyridine, 3-Amino-2-bromopyridine, 3-Amino-5-bromopyridine, 3-AMINO-6-PYRIDINEMETHANOL, View all

3-Amino-6-bromopyridine(CAS No. 13534-97-9)

3-Amino-6-bromopyridine C5H5BrN2 (cas 13534-97-9) Molecular Structure

13534-97-9 Structure

Identification and Related Records

【Name】
3-Amino-6-bromopyridine
【Iupac name】
6-bromopyridin-3-amine
【CAS Registry number】
13534-97-9
【Synonyms】
5-Amino-2-bromopyridine
6-Bromo-3-pyridinamine
2-Bromo-5-Amino Pyridine
2-AMINO-5-BROMOPYRIDINE
【EINECS(EC#)】
214-019-9
【Molecular Formula】
C5H5BrN2 (Products with the same molecular formula)
【Molecular Weight】
173.01
【Inchi】
InChI=1/C5H5BrN2/c6-5-2-1-4(7)3-8-5/h1-3H,7H2
【Canonical SMILES】
C1=CC(=NC=C1N)Br
【MOL File】
13534-97-9.mol

Chemical and Physical Properties

【Appearance】
Light yellow needles
【Density】
1.71 g/cm3
【Melting Point】
75-79℃
【Boiling Point】
291.2 °C at 760 mmHg
【Vapour】
0.00198mmHg at 25°C
【Refractive Index】
1.636
【Flash Point】
291.2 °C at 760 mmHg
【Computed Properties】
Molecular Weight:173.0106 [g/mol]
Molecular Formula:C5H5BrN2
XLogP3-AA:1.2
H-Bond Donor:1
H-Bond Acceptor:2
Rotatable Bond Count:0
Exact Mass:171.963611
MonoIsotopic Mass:171.963611
Topological Polar Surface Area:38.9
Heavy Atom Count:8
Formal Charge:0
Complexity:76.8
Isotope Atom Count:0
Defined Atom Stereocenter Count:0
Undefined Atom Stereocenter Count:0
Defined Bond Stereocenter Count:0
Undefined Bond Stereocenter Count:0
Covalently-Bonded Unit Count:1
Feature 3D Acceptor Count:1
Feature 3D Donor Count:1
Feature 3D Cation Count:1
Feature 3D Hydrophobe Count:1
Feature 3D Ring Count:1
Effective Rotor Count:0
Conformer Sampling RMSD:0.4
CID Conformer Count:1

Safety and Handling

【Hazard Codes】
Xi:Irritant
【Risk Statements】
R36/37/38
【Safety Statements 】
S26;S37/39
【HazardClass】
IRRITANT
【Hazard Note】

Irritant

【PackingGroup 】
III
【Transport】
UN 2811 6.1/PG 3

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