1.02010-04-08 22:11:52 UTC2019-11-26 03:11:41 UTCFDB0154926-Methoxy-2(3H)-benzoxazoloneIsolated from roots of Coix lacryma jobi (Job's tears) and from seedlings of wheat, corn and rye. 6-Methoxy-2(3H)-benzoxazolone is found in many foods, some of which are cereals and cereal products, corn, alcoholic beverages, and coffee and coffee products.2(3H)-Benzoxazolone, 6-methoxy- (9CI)6-MBOA6-Methoxy-1,3-benzoxazol-2(3H)-one6-METHOXY-2-benzoxazolinone6-Methoxy-2-benzoxazolinone, 8CI6-Methoxy-3H-benzooxazol-2-one6-Methoxy-benzoxazolin-2(3H)-one6-Methoxybenzoxazolin-2(3H)-one6-MethoxybenzoxazolinoneCoixolMBOAC8H7NO3165.1461165.0425930956-methoxy-2,3-dihydro-1,3-benzoxazol-2-one6-methoxy-3H-1,3-benzoxazol-2-one532-91-2COC1=CC=C2NC(=O)OC2=C1InChI=1S/C8H7NO3/c1-11-5-2-3-6-7(4-5)12-8(10)9-6/h2-4H,1H3,(H,9,10)MKMCJLMBVKHUMS-UHFFFAOYSA-N belongs to the class of organic compounds known as benzoxazolones. These are organic compounds containing a benzene fused to an oxazole ring (a five-member aliphatic ring with three carbon atoms, one oxygen atom, and one nitrogen atom) bearing a ketone group.BenzoxazolonesOrganic compoundsOrganoheterocyclic compoundsBenzoxazolesBenzoxazolonesAromatic heteropolycyclic compoundsAlkyl aryl ethersAnisolesAzacyclic compoundsHeteroaromatic compoundsHydrocarbon derivativesOrganic oxidesOrganonitrogen compoundsOrganopnictogen compoundsOxacyclic compoundsOxazolesAlkyl aryl etherAnisoleAromatic heteropolycyclic compoundAzacycleAzoleBenzenoidBenzoxazoloneEtherHeteroaromatic compoundHydrocarbon derivativeOrganic nitrogen compoundOrganic oxideOrganic oxygen compoundOrganonitrogen compoundOrganooxygen compoundOrganopnictogen compoundOxacycleOxazolelogp1.21logs-1.21solubility1.01e+01 g/lmelting_pointMp 160-161° (154-155°)logp1.17pka_strongest_acidic9.66pka_strongest_basic-1.8iupac6-methoxy-2,3-dihydro-1,3-benzoxazol-2-oneaverage_mass165.1461mono_mass165.042593095smilesCOC1=CC=C2NC(=O)OC2=C1formulaC8H7NO3inchiInChI=1S/C8H7NO3/c1-11-5-2-3-6-7(4-5)12-8(10)9-6/h2-4H,1H3,(H,9,10)inchikeyMKMCJLMBVKHUMS-UHFFFAOYSA-Npolar_surface_area47.56refractivity42.73polarizability15.7rotatable_bond_count1acceptor_count3donor_count1physiological_charge0formal_charge0Specdb::EiMs1628Specdb::CMs16514Specdb::CMs131173Specdb::CMs138907Specdb::MsIr7285Specdb::MsIr7286Specdb::MsIr7287Specdb::NmrOneD136530Specdb::NmrOneD136531Specdb::NmrOneD136532Specdb::NmrOneD136533Specdb::NmrOneD136534Specdb::NmrOneD136535Specdb::NmrOneD136536Specdb::NmrOneD136537Specdb::NmrOneD136538Specdb::NmrOneD136539Specdb::NmrOneD136540Specdb::NmrOneD136541Specdb::NmrOneD136542Specdb::NmrOneD136543Specdb::NmrOneD136544Specdb::NmrOneD136545Specdb::NmrOneD136546Specdb::NmrOneD136547Specdb::NmrOneD136548Specdb::NmrOneD136549Specdb::MsMs73170Specdb::MsMs73171Specdb::MsMs73172Specdb::MsMs132276Specdb::MsMs132277Specdb::MsMs132278Specdb::MsMs2228682Specdb::MsMs2375831Specdb::MsMs2375832Specdb::MsMs2375833Specdb::MsMs2559981Specdb::MsMs2559982Specdb::MsMs2559983HMDB36582#<Reference:0x000055567633e218>Alcoholic beveragesUnknowngenericAmaranthType 1specificAmaranthus3564Annual wild riceType 1specificZizania aquatica75727Arabica coffeeType 1specificCoffea arabica13443BarleyType 1specificHordeum vulgare4513Black teaType 1Breakfast cerealType 2specificBulgurType 2specificCereals and cereal productsUnknowngenericCoffee and coffee productsUnknowngenericCommon buckwheatType 1specificFagopyrum esculentum3617Common wheatType 1specificTriticum aestivum4565CornType 1specificZea mays4577FlourType 2specificGreen teaType 1Hard wheatType 1specificTriticum durum4567Herbal teaType 1MilletType 1specificPanicum miliaceum4540OatType 1specificAvena sativa4498Oriental wheatType 1specificTriticum turanicum376534QuinoaType 1specificChenopodium quinoa63459Red riceType 1specificOryza rufipogon4529Red teaType 1RiceType 1specificOryza sativa4530Robusta coffeeType 1specificCoffea canephora49390RyeType 1specificSecale cereale4550SorghumType 1specificSorghum bicolor4558Soy beanType 1specificGlycine max3847SpeltType 1specificTriticum spelta58933Tartary buckwheatType 1specificFagopyrum tataricum62330TeaType 1specificCamellia sinensis4442TeffType 1specificEragrostis tef110835TriticaleType 1specificX Triticosecale rimpauiWheatType 1specificTriticum4564Wild riceType 1specificZizania15949anti histaminic331Histamine antagonists are the drugs that bind to but do not activate histamine receptors, thereby blocking the actions of histamine or histamine agonists.anti inflammatory370A substance that reduces or suppresses inflammation.anti pyretic567A drug that prevents or reduces fever by lowering the body temperature from a raised state. An antipyretic will not affect the normal body temperature if one does not have fever. Antipyretics cause the hypothalamus to override an interleukin-induced increase in temperature. The body will then work to lower the temperature and the result is a reduction in fever.tranquilizer1373