Name: Name:3-(Chloromethyl)-5-phenylisoxazole
Brand: AABLOCKS
SKU: AA001EPN
Rating: 90 (10 reviews)

Technical Information

Catalog Number: AA001EPN

Chemical Name: 3-(Chloromethyl)-5-phenylisoxazole

CAS Number: 14731-10-3

Molecular Formula: C10H8ClNO

Molecular Weight: 193.6296

MDL Number: MFCD01444154

SMILES: ClCc1noc(c1)c1ccccc1

Properties

Complexity: 159

Covalently-Bonded Unit Count: 1

Defined Atom Stereocenter Count: 0

Defined Bond Stereocenter Count: 0

Formal Charge: 0

Heavy Atom Count: 13

Hydrogen Bond Acceptor Count: 2

Hydrogen Bond Donor Count: 0

Isotope Atom Count: 0

Rotatable Bond Count: 2

Undefined Atom Stereocenter Count: 0

Undefined Bond Stereocenter Count: 0

XLogP3: 2.5

Downstream Synthesis Route

1619-37-0

14731-10-3

[1]CurrentPatentAssignee:TAKEDAPHARMACEUTICALCOMPANYLIMITED-US6251926,2001,B1

[2]Potkin;Bumagin;Petkevich;Dikusar;Semenova;Kurman;Zolotar';Pashkevich;Gurinovich;Kul'Chitskii[RussianJournalofOrganicChemistry,2015,vol.51,#8,p.1119-1130][ZhurnalOrganicheskoiKhimii,2015,vol.51,#8,p.1119-1130,12]

[3]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-US4812470,1989,A

[4]Li,Zheng;Qiu,Qianqian;Xu,Xue;Wang,Xuekun;Jiao,Lei;Su,Xin;Pan,Miaobo;Huang,Wenlong;Qian,Hai[EuropeanJournalofMedicinalChemistry,2016,vol.113,p.246-257]

[5]He,Haibing;Ge,Yinghua;Dai,Hong;Cui,Song;Ye,Fei;Jin,Jia;Shi,Yujun[Molecules,2016,vol.21,#12]

[6]Bumagin,NikolayA.;Kletskov,AlexeyV.;Petkevich,SergeyK.;Kolesnik,IrynaA.;Lyakhov,AlexanderS.;Ivashkevich,LudmilaS.;Baranovsky,AlexanderV.;Kurman,PeterV.;Potkin,VladimirI.[Tetrahedron,2018,vol.74,#27,p.3578-3588]

[7]Bi,Fangchao;Song,Di;Zhang,Nan;Liu,Zhiyang;Gu,Xinjie;Hu,Chaoyu;Cai,Xiaokang;Venter,Henrietta;Ma,Shutao[EuropeanJournalofMedicinalChemistry,2018,vol.159,p.90-103]

[8]Kolesnik;Petkevich;Mertsalov;Chervyakova;Nadirova;Tyurin;Guan;Liu;Potkin[RussianJournalofGeneralChemistry,2022,vol.92,#1,p.29-39][Zh.Obshch.Khim.,2022,vol.92,#1,p.44-55]

[9]Kolesnik;Petkevich;Mertsalov;Chervyakova;Nadirova;Tyurin;Guan;Liu;Potkin[RussianJournalofGeneralChemistry,2022,vol.92,#1,p.29-39][Zh.Obshch.Khim.,2022,vol.92,#1,p.44-55]

14731-10-3

140-66-9

3-4-(2,4,4-trimethylpentan-2-yl)phenoxymethyl}-5-phenylisoxazole

[1]RussianJournalofOrganicChemistry,2015,vol.51,p.1119-1130 ZhurnalOrganicheskoiKhimii,2015,vol.51,p.1119-1130,12

7063-99-2

14731-10-3

[1]EuropeanJournalofMedicinalChemistry,2016,vol.113,p.246-257

[2]Patent:US6251926,2001,B1

[3]EuropeanJournalofMedicinalChemistry,2018,vol.159,p.90-103

59985-82-9

14731-10-3

[1]Petkevich;Dikusar;Kletskov;Rozenzveig;Levkovskaya;Kurman;Zolotar’;Potkin[RussianJournalofGeneralChemistry,2018,vol.88,#2,p.234-240][Zh.Obshch.Khim.,2018,vol.88,#2,p.255-261,7]

[2]Bumagin,NikolayA.;Kletskov,AlexeyV.;Petkevich,SergeyK.;Kolesnik,IrynaA.;Lyakhov,AlexanderS.;Ivashkevich,LudmilaS.;Baranovsky,AlexanderV.;Kurman,PeterV.;Potkin,VladimirI.[Tetrahedron,2018,vol.74,#27,p.3578-3588]

951122-37-5

14731-10-3

3-((5-phenylisoxazol-3-yl)methoxy)-2,6-difluorobenzamide

[1]EuropeanJournalofMedicinalChemistry,2018,vol.159,p.90-103

14731-10-3 | 3-(Chloromethyl)-5-phenylisoxazole