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17133-48-1,MFCD00099469
Catalog No.:AA003GRB

17133-48-1 | 2-Chloro-1-(2,3-dihydro-indol-1-yl)-ethanone

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250mg
95%
1 week  
$103.00   $72.00
- +
1g
95%
1 week  
$277.00   $194.00
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5g
95%
1 week  
$877.00   $614.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003GRB
Chemical Name:
2-Chloro-1-(2,3-dihydro-indol-1-yl)-ethanone
CAS Number:
17133-48-1
Molecular Formula:
C10H10ClNO
Molecular Weight:
195.6455
MDL Number:
MFCD00099469
SMILES:
ClCC(=O)N1CCc2c1cccc2
NSC Number:
151880
Properties
Properties
 
BP:
388.3°C at 760 mmHg  
Form:
Solid  
MP:
130-132°C  
Storage:
Keep in dry area;-20 ℃;  

Computed Properties
 
Complexity:
207  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
1.9  

Downstream Synthesis Route

[1]CurrentPatentAssignee:UNIVERSITYOFDUNDEE-US2014/148452,2014,A1Locationinpatent:Paragraph0184-0187

[2]Otsuka,Rikuto;Maruhashi,Kazuo;Ohwada,Tomohiko[Synthesis,2018,vol.50,#10,p.2041-2057]

[3]Miura,Tomoya;Murakami,Masahiro;Oku,Naoki[OrganicLetters,2022,vol.24,#8,p.1616-1619]

[4]Gao,Quanqing;Hanh,Jacky;Váradi,Linda;Cairns,Rose;Sjöström,Helena;Liao,VivianW.Y.;Wood,Peta;Balaban,Seher;Ong,JenniferAi;Lin,Hsuan-YuJennifer;Lai,Felcia;Hoy,AndrewJ.;Grewal,Thomas;Groundwater,PaulW.;Hibbs,DavidE.[BioorganicandMedicinalChemistry,2015,vol.23,#24,p.7676-7684]

[5]Diehl,Klaus;Himbert,Gerhard[ChemischeBerichte,1986,vol.119,#9,p.2874-2888]

[6]CurrentPatentAssignee:UNIVERSITYOFCALIFORNIA-WO2018/144869,2018,A1Locationinpatent:Paragraph0619;0621

[7]Hach;Protiva[CollectionofCzechoslovakChemicalCommunications,1953,vol.18,p.684,686,691][Chem.Abstr.,1955,p.204]Hach;Protiva[ChemickeListy,1953,vol.47,p.729,730][CollectionofCzechoslovakChemicalCommunications,1953,vol.18,p.684,686][Chem.Abstr.,1955,p.204]

[8]Zhao,He;Thurkauf,Andrew;He,Xiaoshu;Hodgetts,Kevin;Zhang,Xiaoyan;Rachwal,Stanislaw;Kover,RenataX.;Hutchison,Alan;Peterson,John;Kieltyka,Andrzej;Brodbeck,Robbin;Primus,Renee;Wasley,JanW.F.[BioorganicandMedicinalChemistryLetters,2002,vol.12,#21,p.3105-3109]

[9]CurrentPatentAssignee:PFIZERINC-WO2008/15516,2008,A1Locationinpatent:Page/Pagecolumn44

[10]CurrentPatentAssignee:UNIVERSITYOFDUNDEE-WO2012/160392,2012,A1Locationinpatent:Page/Pagecolumn49

[11]Li,Zhanshan;Wang,Weixia;Zhang,Xiaotian;Hu,Congcong;Zhang,Wei[Synlett,2013,vol.24,#1,p.73-78]

[12]Romaine,IanM.;Taylor,RobertW.;Saidu,SamsudeenP.;Kim,Kwangho;Sulikowski,GaryA.;Zwiebel,LaurenceJ.;Waterson,AlexG.[BioorganicandMedicinalChemistryLetters,2014,vol.24,#12,p.2613-2616]

[13]Weidner,Karin;Sun,Zhongdong;Kumagai,Naoya;Shibasaki,Masakatsu[AngewandteChemie-InternationalEdition,2015,vol.54,#21,p.6236-6240][Angew.Chem.,2015,vol.54,#21,p.6334-6338]

[14]Senwar,KishnaRam;Reddy,T.Srinivasa;Thummuri,Dinesh;Sharma,Pankaj;Naidu;Srinivasulu,Gannoju;Shankaraiah,Nagula[EuropeanJournalofMedicinalChemistry,2016,vol.118,p.34-46]

[15]CurrentPatentAssignee:TAKEDAPHARMACEUTICALCOMPANYLIMITED-WO2018/47983,2018,A1Locationinpatent:Page/Pagecolumn49

[16]AbdelGawad,NagwaM.;ElKerdawy,AhmedM.;George,RihamF.;Georgey,HananH.;Mohamed,AbdallaR.[BioorganicChemistry,2021,vol.107]

[17]Alotaibi,Faez;Halaweish,Fathi;Halaweish,Hossam;Iram,Surtaj;Kasten,Abigail;Kyeremateng,Jennifer;Ostlund,Trevor[Steroids,2022,vol.177]

[18]Alotaibi,Faez;Halaweish,Fathi;Halaweish,Hossam;Iram,Surtaj;Kasten,Abigail;Kyeremateng,Jennifer;Ostlund,Trevor[Steroids,2022,vol.177]

[1]CurrentPatentAssignee:UNIVERSITYOFDUNDEE-WO2012/160392,2012,A1Locationinpatent:Page/Pagecolumn49-50

[2]CurrentPatentAssignee:UNIVERSITYOFDUNDEE-US2014/148452,2014,A1Locationinpatent:Paragraph0189-0192

[1]CurrentPatentAssignee:UNIVERSITYOFDUNDEE-WO2012/160392,2012,A1

[2]CurrentPatentAssignee:UNIVERSITYOFDUNDEE-US2014/148452,2014,A1

[1]CurrentPatentAssignee:XUCHANGUNIVERSITY-CN107098844,2017,ALocationinpatent:Paragraph0055-0058

[2]Li,Dandan;Chen,Yimeng;Ma,Mengya;Yu,Yanling;Jia,Zhenzhen;Li,Penghui;Xie,Zhiyu[SyntheticCommunications,2019,vol.49,#10,p.1231-1240]

Literature
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SDS
Tags:17133-48-1 Molecular Formula|17133-48-1 MDL|17133-48-1 SMILES|17133-48-1 2-Chloro-1-(2,3-dihydro-indol-1-yl)-ethanone