AG003N4Y

21594-52-5 | 6-bromo-3H-oxazolo[4,5-b]pyridin-2-one

AG003N4Y

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CAS Number	21594-52-5
Catalog Number	AG003N4Y(AGN-PC-00NASF)
Chemical Name	6-bromo-3H-oxazolo[4,5-b]pyridin-2-one
EC Number	676-057-6
IUPAC Name	6-bromo-3H-[1,3]oxazolo[4,5-b]pyridin-2-one
InChI	InChI=1S/C6H3BrN2O2/c7-3-1-4-5(8-2-3)9-6(10)11-4/h1-2H,(H,8,9,10)
InChI Key	VQPBRWIFFBIRRP-UHFFFAOYSA-N
MDL Number	MFCD08689590
Molecular Formula	C6H3BrN2O2
Molecular Weight	215.0042
SMILES	BrC1=CN=C2C(=C1)OC(N2)=O
Synonyms	6-Bromo-3H-oxazolo[4,5-b]pyridin-2-one, 21594-52-5, 6-bromooxazolo[4,5-b]pyridin-2(3H)-one, 6-BROMO-2H,3H-[1,3]OXAZOLO[4,5-B]PYRIDIN-2-ONE, Oxazolo[4,5-b]pyridin-2(3H)-one, 6-bromo-, 6-BROMO[1,3]OXAZOLO[4,5-B]PYRIDIN-2(3H)-ONE, 6-Bromo-oxazolo[4,5-b]pyridin-2-ol, 6-bromo-oxazolo[4,5-b]pyridin-2(3H)-one, 6-bromo-3H-[1,3]oxazolo[4,5-b]pyridin-2-one, 6-Bromo[1,3]oxazolo[4,5-b]pyridin-2(3H)-one, 97%, PubChem17712, ACMC-1CAKB, SCHEMBL488612, CTK4E7226, DTXSID50545057, VQPBRWIFFBIRRP-UHFFFAOYSA-N, 6-bromooxooxazolo[4,5-b]pyridine, BCP10942, KS-000002HR, ABBYPHARMA AP-13-10235, ANW-50746, MFCD08689590, STL476660, ZINC15442574, AKOS015918829, AC-9225, AN-7212, CB-2785, CS-W003545, DS-0362, FS-2282, QC-4162, RP26852, RTC-063702, TRA0084571, WT82320, AJ-67391, AK-24539, AM803518, BC004279, BR-24539, CJ-15117, SC-28446, SY007993, 6-Bromooxazolo[4,5-b]pyridine-2(3H)-one, AB0023432, AB1001032, DB-032265, ST2412223, TC-063702, 4CH-000379, A4641, FT-0648486, W4484, 6-bromo-oxazolo[4,5-b]-pyridin-2(3H)-one, Oxazolo[4,5-b]pyridin-2(3H)-one,6-bromo-, A-2478, Z-8347, MFCD08689590 (97+%), 594B525, 6-Bromo[1?3]oxazolo[4?5-b]pyridin-2(3H)-one, 6-bromo-[1,3]-oxazolo[4,5-b]pyridin-2(3H)-one, 6-BROMO-3H-OXAZOLO[4,5-b]-PYRIDIN-2-ONE, J-014165, J-518371, S14-0152, 6-Bromo-3H-oxazolo[4,5-b]pyridin-2-one, AldrichCPR, Z1741969429, null, Acetoacetyl cyclopropane, C6H3BrN2O2, ACN-032270,

Complexity	187
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	213.938g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	215.006g/mol
Monoisotopic Mass	213.938g/mol
Rotatable Bond Count	0
Topological Polar Surface Area	51.2A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.1

GHS Hazard and Precautionary Statements

Symbol:
Hazard statements	H315-H319-H335
Precuationary statements	P261-P305+P351+P338
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Certificate of Analysis

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