Imidazo[1,2-b]pyridazine-2-carboxylic Acid - CAS 160911-42-2

Catalog:	BB011680
Product Name:	Imidazo[1,2-b]pyridazine-2-carboxylic Acid
CAS:	160911-42-2
Synonyms:	2-imidazo[1,2-b]pyridazinecarboxylic acid; imidazo[1,2-b]pyridazine-2-carboxylic acid

Technical Data

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Computed Properties

IUPAC Name:	imidazo[1,2-b]pyridazine-2-carboxylic acid
Description:	Imidazo[1,2-b]pyridazine-2-carboxylic Acid (CAS# 160911-42-2) is a useful research chemical.
Molecular Weight:	163.13
Molecular Formula:	C7H5N3O2
Canonical SMILES:	C1=CC2=NC(=CN2N=C1)C(=O)O
InChI:	InChI=1S/C7H5N3O2/c11-7(12)5-4-10-6(9-5)2-1-3-8-10/h1-4H,(H,11,12)
InChI Key:	ONVUCPOYNIOJFY-UHFFFAOYSA-N
Density:	1.585 g/cm³
MDL:	MFCD08235229
LogP:	0.42750

Publication Number	Title	Priority Date
US-2019292150-A1	Ido-tdo dual inhibitor and related methods of use	20180323
WO-2019180686-A1	Ido-tdo dual inhibitor and related methods of use	20180323
TW-202003513-A	Inhibitors of plasma kallikrein and uses thereof	20180313
KR-20200092346-A	Heterocyclic compounds as PRMT5 inhibitors	20171124
CN-107486159-A	The curing materials for being used to fix manganese in river bottom mud based on attapulgite	20171013

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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+P312, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	197
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	163.038176411
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	1
Isotope Atom Count:	0
Monoisotopic Mass:	163.038176411
Rotatable Bond Count:	1
Topological Polar Surface Area:	67.5 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	0.2