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67852-98-6,MFCD09418546
Catalog No.:AA0062NX

67852-98-6 | Methyl 4-(tert-butylcarbamoyl)benzoate

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Purity
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Price(USD)
Quantity
  
1g
98%
in stock  
$95.00   $67.00
- +
5g
98%
in stock  
$261.00   $183.00
- +
10g
98%
in stock  
$427.00   $299.00
- +
25g
98%
in stock  
$809.00   $567.00
- +
100g
98%
in stock  
$2,140.00   $1,498.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA0062NX
Chemical Name:
Methyl 4-(tert-butylcarbamoyl)benzoate
CAS Number:
67852-98-6
Molecular Formula:
C13H17NO3
Molecular Weight:
235.2790
MDL Number:
MFCD09418546
SMILES:
COC(=O)c1ccc(cc1)C(=O)NC(C)(C)C
Properties
Properties
 
Form:
Solid  
Storage:
Room Temperature;  

Computed Properties
 
Complexity:
286  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
4  
XLogP3:
2.5  

Downstream Synthesis Route

[1]Milne,JacquelineE.;Baum,JeanC.[OrganicSyntheses,2012,vol.89,p.519-526]

[2]Baum,JeanC.;Milne,JacquelineE.;Murry,JerryA.;Thiel,OliverR.[JournalofOrganicChemistry,2009,vol.74,#5,p.2207-2209]

[3]Reddy,K.Laxma[TetrahedronLetters,2003,vol.44,#7,p.1453-1455]

[1]CurrentPatentAssignee:SUMITOMOCHEMICALCOMPANYLIMITED;SumitomoChemical(w/oDongwooFine-Chem);SumitomoPharma(in:SumitomoChemical)-US6384033,2002,B1

[1]Ryu,Jaeyune;Shin,Kwangmin;Park,SaeHume;Kim,JiYoung;Chang,Sukbok[AngewandteChemie-InternationalEdition,2012,vol.51,#39,p.9904-9908]

[1]Ryu,Jaeyune;Shin,Kwangmin;Park,SaeHume;Kim,JiYoung;Chang,Sukbok[AngewandteChemie-InternationalEdition,2012,vol.51,#39,p.9904-9908]

[2]Kim,Jiyu;Kim,Jinwoo;Chang,Sukbok[Chemistry-AEuropeanJournal,2013,vol.19,#23,p.7328-7333]

[3]Ryu,Jaeyune;Kwak,Jaesung;Shin,Kwangmin;Lee,Donggun;Chang,Sukbok[JournaloftheAmericanChemicalSociety,2013,vol.135,#34,p.12861-12868]

[4]Zhang,Tao;Hu,Xuejiao;Wang,Zhen;Yang,Tiantian;Sun,Hao;Li,Guigen;Lu,Hongjian[Chemistry-AEuropeanJournal,2016,vol.22,#9,p.2920-2924]

[5]Zhang,Tao;Wang,Zhen;Hu,Xuejiao;Yu,Meng;Deng,Tianning;Li,Guigen;Lu,Hongjian[JournalofOrganicChemistry,2016,vol.81,#11,p.4898-4905]

[6]Bera,SouravSekhar;Debbarma,Suvankar;Ghosh,AvickKumar;Chand,Santanu;Maji,ModhuSudan[JournalofOrganicChemistry,2017,vol.82,#1,p.420-430]

[7]Shi,Yang;Zhang,Luoqiang;Lan,Jingbo;Zhang,Min;Zhou,Fulin;Wei,Wenlong;You,Jingsong[AngewandteChemie-InternationalEdition,2018,vol.57,#29,p.9108-9112][Angew.Chem.,2018,vol.130,p.9246-9250,5]

[8]Chen,Lei;Su,Xiao-Can;Peng,Rui-Jun;Zhang,Xue-Jing;Yan,Ming[OrganicandBiomolecularChemistry,2022,vol.20,#16,p.3268-3272]

941-55-9    67852-98-6   
methyl4-(N-tert-butylaminocarbonyl)-3-(4-methylphenylsulfonamido)benzoate 

[1]Lee,Donggun;Kim,Youngchan;Chang,Sukbok[JournalofOrganicChemistry,2013,vol.78,#21,p.11102-11109]

[2]Kim,Jiyu;Kim,Jinwoo;Chang,Sukbok[Chemistry-AEuropeanJournal,2013,vol.19,#23,p.7328-7333]

Literature
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Tags:67852-98-6 Molecular Formula|67852-98-6 MDL|67852-98-6 SMILES|67852-98-6 Methyl 4-(tert-butylcarbamoyl)benzoate