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67191-93-9,MFCD00037072
Catalog No.:AA00346Z

67191-93-9 | 5-Fluoro-2-methylphenyl isocyanate

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250mg
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  • Downstream Synthesis Route
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
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Technical Information
Catalog Number:
AA00346Z
Chemical Name:
5-Fluoro-2-methylphenyl isocyanate
CAS Number:
67191-93-9
Molecular Formula:
C8H6FNO
Molecular Weight:
151.1377
MDL Number:
MFCD00037072
SMILES:
Cc1ccc(cc1N=C=O)F
Properties
Properties
 
Form:
Liquid  
Storage:
2-8℃;Keep in dry area;  

Computed Properties
 
Complexity:
177  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
1  
XLogP3:
3.2  

Downstream Synthesis Route
275815-63-9    67191-93-9   
1-{(1R,2S)-2-(S)-3-(4-Fluoro-benzyl)-piperidin-1-ylmethyl-cyclohexyl}-3-(5-fluoro-2-methyl-phenyl)-urea 

[1]DeLucca,GeorgeV.;Ui,TaeKim;Vargo,BrianJ.;Duncia,JohnV.;SantellaIII,JosephB.;Gardner,DanielS.;Zheng,Changsheng;Liauw,Ann;Wang,Zhang;Emmett,George;Wacker,DeanA.;Welch,PatriciaK.;Covington,Maryanne;Stowell,NicoleC.;Wadman,EricA.;Das,AnukM.;Davies,Paul;Yeleswaram,Swamy;Graden,DanielleM.;Solomon,KimberlyA.;Newton,RobertC.;Trainor,GeorgeL.;Decicco,CarlP.;Ko,SooS.[JournalofMedicinalChemistry,2005,vol.48,#6,p.2194-2211]

[1]Locationinpatent:experimentalpartMuro,Fumihito;Iimura,Shin;Yoneda,Yoshiyuki;Chiba,Jun;Watanabe,Toshiyuki;Setoguchi,Masaki;Iigou,Yutaka;Takayama,Gensuke;Yokoyama,Mika;Takashi,Tohru;Nakayama,Atsushi;Machinaga,Nobuo[BioorganicandMedicinalChemistry,2008,vol.16,#23,p.9991-10000]

tert-butyl2-amino-4-(3-aminopropyl)-1H-imidazole-1-carboxylate 
  67191-93-9    1176233-73-0 

[1]Richards,JustinJ.;Reyes,Samuel;Stowe,SeanD.;Tucker,AshleyT.;Ballard,T.Eric;Mathies,LauraD.;Cavanagh,John;Melander,Christian[JournalofMedicinalChemistry,2009,vol.52,#15,p.4582-4585]

[1]Locationinpatent:experimentalpartHutinec,Antun;Rupcic,Renata;Ziher,Dinko;Smith,KirstenS.;Milhous,Wilbur;Ellis,William;Ohrt,Colin;Schoenfeld,ZrinkaIvezic[BioorganicandMedicinalChemistry,2011,vol.19,#5,p.1692-1701]

[1]Locationinpatent:experimentalpartJadhav,RavindraD.;Kadam,KishorkumarS.;Kandre,Shivaji;Guha,Tandra;Reddy,M.MaheshKumar;Brahma,ManojaK.;Deshmukh,NitinJ.;Dixit,Amol;Doshi,Lalit;Potdar,Nisha;Enose,ArnoA.;Vishwakarma,RamA.;Sivaramakrishnan;Srinivasan,Shaila;Nemmani,KumarV.S.;Gupte,Amol;Gangopadhyay,AshokK.;Sharma,Rajiv[EuropeanJournalofMedicinalChemistry,2012,vol.54,p.324-342]

Literature
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Tags:67191-93-9 Molecular Formula|67191-93-9 MDL|67191-93-9 SMILES|67191-93-9 5-Fluoro-2-methylphenyl isocyanate |Organic_Building_Blocks