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7-Bromo-1H-pyrazolo[3,4-c]pyridine

7-Bromo-1H-pyrazolo[3,4-c]pyridine - CAS 957760-11-1

Catalog:	BB041843
Product Name:	7-Bromo-1H-pyrazolo[3,4-c]pyridine
CAS:	957760-11-1
Synonyms:	7-bromo-1H-pyrazolo[3,4-c]pyridine; 7-bromo-1H-pyrazolo[3,4-c]pyridine

Technical Data

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Patents

Computed Properties

IUPAC Name:	7-bromo-1H-pyrazolo[3,4-c]pyridine
Description:	7-Bromo-1H-pyrazolo[3,4-c]pyridine (CAS# 957760-11-1) is a useful research chemical.
Molecular Weight:	198.02
Molecular Formula:	C6H4BrN3
Canonical SMILES:	C1=CN=C(C2=C1C=NN2)Br
InChI:	InChI=1S/C6H4BrN3/c7-6-5-4(1-2-8-6)3-9-10-5/h1-3H,(H,9,10)
InChI Key:	TZZAHSRLUFTAFW-UHFFFAOYSA-N
LogP:	1.72040

Publication Number	Title	Priority Date
EP-3597642-A1	Pharmaceutical 6,5 heterobicyclic ring derivatives	20180720
WO-2019158731-A1	Pharmaceutical 6,5 heterobicyclic ring derivatives	20180216
EP-3752150-A1	Pharmaceutical 6,5 heterobicyclic ring derivatives	20180216
KR-20200121823-A	Pharmaceutical 6,5 heterobicyclic ring derivative	20180216
US-2020399268-A1	Pharmaceutical 6,5 Heterobicyclic Ring Derivatives	20180216

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H312 (100%): Harmful in contact with skin [Warning Acute toxicity, dermal]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H332 (100%): Harmful if inhaled [Warning Acute toxicity, inhalation]; H335 (100%): 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, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	130
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	196.95886
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	2
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	196.95886
Rotatable Bond Count:	0
Topological Polar Surface Area:	41.6
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.5