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1140-38-1,MFCD00548507
Catalog No.:AA000A70

1140-38-1 | 5-Chloro-3-methyl-1-phenyl-1h-pyrazole-4-carboxylic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
1 week  
$53.00   $37.00
- +
1g
95%
1 week  
$141.00   $99.00
- +
5g
95%
1 week  
$486.00   $341.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA000A70
Chemical Name:
5-Chloro-3-methyl-1-phenyl-1h-pyrazole-4-carboxylic acid
CAS Number:
1140-38-1
Molecular Formula:
C11H9ClN2O2
Molecular Weight:
236.6544
MDL Number:
MFCD00548507
SMILES:
OC(=O)c1c(C)nn(c1Cl)c1ccccc1
Properties
Computed Properties
 
Complexity:
269  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
2.8  

Downstream Synthesis Route

[1]BulletindelaSocieteChimiquedeFrance,1942,vol.<5>9,p.718

[1]Mu,Jin-Xia;Shi,Yan-Xia;Yang,Ming-Yan;Sun,Zhao-Hui;Liu,Xing-Hai;Li,Bao-Ju;Sun,Na-Bo[Molecules,2016,vol.21,#1]

[2]González-López,Edwin;Grande-Tovar,CarlosD.;León-Jaramillo,Jhair;Peralta-Ruiz,Yeimmy;Quiroga,Jairo;Trilleras,Jorge[JournaloftheBrazilianChemicalSociety,2020,vol.31,#9,p.1917-1925]

[3]Zhao,Dongmei;Sun,Bin;Ren,Jinhong;Li,Fengrong;Song,Shuai;Lv,Xuejiao;Hao,Chenzhou;Cheng,Maosheng[BioorganicandMedicinalChemistry,2015,vol.23,#6,p.1356-1365]

[4]Sun,Bin;Liu,Kai;Han,Jing;Zhao,Li-Yu;Su,Xiao;Lin,Bin;Zhao,Dong-Mei;Cheng,Mao-Sheng[BioorganicandMedicinalChemistry,2015,vol.23,#20,p.6763-6773]

[5]CurrentPatentAssignee:SHENYANGPHARMACEUTICALUNIVERSITY-CN105541828,2016,ALocationinpatent:Paragraph0638;0639

[6]AbdEl-Aal,HassanA.K.;Khalaf,AliA.[AustralianJournalofChemistry,2016,vol.69,#6,p.652-661]

[7]Abdel-Azzem;Zahran[BulletinoftheChemicalSocietyofJapan,1994,vol.67,#7,p.1879-1880]

[8]Liu,Hong;Yang,Gao-Shan;Liu,Chong-Bo;Lin,Yi;Yang,Yi;Gong,Yun-Nan[JournalofCoordinationChemistry,2014,vol.67,#4,p.572-587]

[9]Farghaly,Abdel-Rahman;Esmail,Sabah;Abdel-Hafez,Ali;Vanelle,Patrice;El-Kashef,Hussein[ARKIVOC,2012,vol.2012,#7,p.228-241]

[10]Depa,Navaneetha;Erothu,Harikrishna[MedicinalChemistryResearch,2021,vol.30,#5,p.1087-1098]

[11]Purohit,MeenaK.;Scovell,Iain;Neschadim,Anton;Katsman,Yulia;Branch,DonaldR.;Kotra,LakshmiP.[BioorganicandMedicinalChemistryLetters,2013,vol.23,#8,p.2324-2327]

[12]Liming,Hu;Xueshu,Li;Zhiyuan,Chen;Xiaopeng,Liu;Zhaojie,Liu[HeterocyclicCommunications,2003,vol.9,#2,p.199-202]

[13]Liu,Ying;Ren,Jun;Jin,Gui-Yu[JournalofChemicalResearch,2004,#1,p.50-52]

[14]Locationinpatent:experimentalpartDatterl,Barbara;Troestner,Nicole;Kucharski,Dorota;Holzer,Wolfgang[Molecules,2010,vol.15,#9,p.6106-6126]

[15]Iaroshenko,ViktorO.;Knepper,Ingo;Zahid,Muhammad;Kuzora,Rene;Dudkin,Sergii;Villinger,Alexander;Langer,Peter[OrganicandBiomolecularChemistry,2012,vol.10,#15,p.2955-2959]

[16]Locationinpatent:schemeortableWu,Jian;Shi,Qing;Chen,Zhuo;He,Ming;Jin,Linhong;Hu,Deyu[Molecules,2012,vol.17,#5,p.5139-5150]

[17]Xiao,Jin-Jing;Liao,Min;Chu,Ming-Jie;Ren,Zi-Li;Zhang,Xin;Lv,Xian-Hai;Cao,Hai-Qun[Molecules,2015,vol.20,#1,p.807-821]

[18]CurrentPatentAssignee:ZHEJIANGSHURENUNIVERSITY-CN105418505,2016,ALocationinpatent:Paragraph0011;0040

[19]Lv,Xian-Hai;Ren,Zi-Li;Liu,Hao;Li,Hai-Dong;Li,Qing-Shan;Wang,Li;Zhang,Li-Song;Yao,Xiao-Kang;Cao,Hai-Qun[ChemicalandPharmaceuticalBulletin,2018,vol.66,#4,p.358-362]

[20]Chu,Ming-Jie;Wang,Wei;Ren,Zi-Li;Liu,Hao;Cheng,Xiang;Mo,Kai;Wang,Li;Tang,Feng;Lv,Xian-Hai[Molecules,2019,vol.24,#7]

[21]CurrentPatentAssignee:UNIVKAILI-CN110698462,2020,ALocationinpatent:Paragraph0045;0064;0082-0083

[1]BulletindelaSocieteChimiquedeFrance,1942,vol.9,p.721,723

[1]BulletindelaSocieteChimiquedeFrance,1942,vol.9,p.721,723

5334-43-0    1140-38-1   
5-chloro-N-(4-cyano-1-phenyl-1H-pyrazol-5-yl)-3-methyl-1-phenyl-1H-pyrazole-4-carboxamide 

[1]Molecules,2015,vol.20,p.807-821

Literature
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Tags:1140-38-1 Molecular Formula|1140-38-1 MDL|1140-38-1 SMILES|1140-38-1 5-Chloro-3-methyl-1-phenyl-1h-pyrazole-4-carboxylic acid