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Methyl Imidazo[1,2-a]pyridine-6-carboxylate

Methyl Imidazo[1,2-a]pyridine-6-carboxylate - CAS 136117-69-6

Catalog:	BB008303
Product Name:	Methyl Imidazo[1,2-a]pyridine-6-carboxylate
CAS:	136117-69-6
Synonyms:	6-imidazo[1,2-a]pyridinecarboxylic acid methyl ester; methyl imidazo[1,2-a]pyridine-6-carboxylate

Technical Data

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Patents

Computed Properties

IUPAC Name:	methyl imidazo[1,2-a]pyridine-6-carboxylate
Description:	Methyl Imidazo[1,2-a]pyridine-6-carboxylate (CAS# 136117-69-6) is a useful research chemical.
Molecular Weight:	176.17
Molecular Formula:	C9H8N2O2
Canonical SMILES:	COC(=O)C1=CN2C=CN=C2C=C1
InChI:	InChI=1S/C9H8N2O2/c1-13-9(12)7-2-3-8-10-4-5-11(8)6-7/h2-6H,1H3
InChI Key:	BTDBMFODXFTFIL-UHFFFAOYSA-N
Density:	1.26 g/cm³
Appearance:	Solid
MDL:	MFCD06200984
LogP:	1.12090

Publication Number	Title	Priority Date
CN-109824665-A	N- ((2- phenylimidazole simultaneously [1,2-a] pyridin-3-yl) methyl) benzenesulfonamides synthesis	20190226
TW-202010742-A	Substituted benzofuran, benzopyrrole,benzothiophene, and structurally related complement inhibitors	20180406
TW-202003513-A	Inhibitors of plasma kallikrein and uses thereof	20180313
CN-112135825-A	Plasma kallikrein inhibitors and uses thereof	20180313
CN-107635984-A	Two ring azoles pesticides of heterocyclic substituted	20150311

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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:	208
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	176.058577502
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	176.058577502
Rotatable Bond Count:	2
Topological Polar Surface Area:	43.6 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	1.6