2-Bromo-5-hydroxypyrimidine - CAS 1240621-87-7

Catalog:	BB005809
Product Name:	2-Bromo-5-hydroxypyrimidine
CAS:	1240621-87-7
Synonyms:	2-bromo-5-pyrimidinol; 2-bromopyrimidin-5-ol

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	2-bromopyrimidin-5-ol
Description:	2-Bromo-5-hydroxypyrimidine (CAS# 1240621-87-7) is a useful research chemical.
Molecular Weight:	174.98
Molecular Formula:	C4H3BrN2O
Canonical SMILES:	C1=C(C=NC(=N1)Br)O
InChI:	InChI=1S/C4H3BrN2O/c5-4-6-1-3(8)2-7-4/h1-2,8H
InChI Key:	QHUDDDWGZQPDIC-UHFFFAOYSA-N
Storage:	Inert atmosphere, 2-8 °C
LogP:	0.94470

Publication Number	Title	Priority Date
WO-2020248065-A1	Unsaturated heterocycloalkyl and heteroaromatic acyl hydrazone linkers, methods and uses thereof	20190612
WO-2020163193-A1	Bicyclic ether o-glycoprotein-2-acetamido-2-deoxy-3-d-glucopyranosidase inhibitors	20190204
TW-202045501-A	Bicyclic ether o-glycoprotein-2-acetamido-2-de oxy-3-d-glucopyranosidase inhibitors	20190204
CN-112771027-A	Lysophosphatidic acid receptor antagonists and process for their preparation	20190115
WO-2020123272-A1	Pyrazolopyrimidine pde9 inhibitors	20181212

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	72.4
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	173.94288
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	173.94288
Rotatable Bond Count:	0
Topological Polar Surface Area:	46 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.9