3-Amino-2-bromo-5-fluoropyridine - CAS 884495-03-8

Catalog:	BB038870
Product Name:	3-Amino-2-bromo-5-fluoropyridine
CAS:	884495-03-8
Synonyms:	2-bromo-5-fluoro-3-pyridinamine; 2-bromo-5-fluoropyridin-3-amine

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	2-bromo-5-fluoropyridin-3-amine
Description:	3-Amino-2-bromo-5-fluoropyridine (CAS# 884495-03-8) is a useful research chemical.
Molecular Weight:	191.00
Molecular Formula:	C5H4BrFN2
Canonical SMILES:	C1=C(C(=NC=C1F)Br)N
InChI:	InChI=1S/C5H4BrFN2/c6-5-4(8)1-3(7)2-9-5/h1-2H,8H2
InChI Key:	QUZAKZBKMMUARE-UHFFFAOYSA-N
Boiling Point:	273.6 °C at 760 mmHg
Density:	1.813 g/cm³
MDL:	MFCD05662413
LogP:	2.14660

Publication Number	Title	Priority Date
EP-3901152-A1	Kv3 enhancers for the treatment of cognitive disorders	20200423
WO-2021127397-A1	Nitrogen heterocyclic compounds and methods of use	20191219
WO-2021115286-A1	Six-membered and five-membered aromatic ring derivative containing nitrogen heteroatoms which can be used as shp2 inhibitor	20191210
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GHS Hazard Statement:	H302 (88.37%): Harmful if swallowed [Warning Acute toxicity, oral]; H315 (11.63%): Causes skin irritation [Warning Skin corrosion/irritation]; H318 (88.37%): Causes serious eye damage [Danger Serious eye damage/eye irritation]; H319 (11.63%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (13.95%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement:	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	101
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	189.95419
Formal Charge:	0
Heavy Atom Count:	9
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	189.95419
Rotatable Bond Count:	0
Topological Polar Surface Area:	38.9
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.3