Home Bromides 1131587-94-4
1131587-94-4,MFCD11112987
Catalog No.:AA003RUO

1131587-94-4 | Methyl 5-bromo-4-methoxy-2-methylbenzoate

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Purity
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100mg
97%
in stock  
$6.00   $4.00
- +
250mg
95%
in stock  
$13.00   $9.00
- +
1g
95%
in stock  
$27.00   $19.00
- +
25g
98%
in stock  
$544.00   $381.00
- +
100g
98%
in stock  
$1,808.00   $1,266.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003RUO
Chemical Name:
Methyl 5-bromo-4-methoxy-2-methylbenzoate
CAS Number:
1131587-94-4
Molecular Formula:
C10H11BrO3
Molecular Weight:
259.0965
MDL Number:
MFCD11112987
SMILES:
COC(=O)c1cc(Br)c(cc1C)OC
Properties
Properties
 
BP:
313.7±37.0°C at 760 mmHg  
Form:
Solid  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
208  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
3  
XLogP3:
2.8  

Downstream Synthesis Route

[1]Yokokawa,Fumiaki;Nilar,Shahul;Noble,ChristianG.;Lim,SiewPheng;Rao,Ranga;Tania,Stefani;Wang,Gang;Lee,Gladys;Hunziker,Jürg;Karuna,Ratna;Manjunatha,Ujjini;Shi,Pei-Yong;Smith,PaulW.[JournalofMedicinalChemistry,2016,vol.59,#8,p.3935-3952]

CASUnavailable 
  875245-69-5    1131587-94-4 

[1]CurrentPatentAssignee:NAVITORPHARM;NAVITORPHARMACEUTICALS-US2018/127370,2018,A1Locationinpatent:Paragraph0887;0884

[2]CurrentPatentAssignee:NANTONGUNIVERSITY-CN109053542,2018,ALocationinpatent:Page/Pagecolumn5-7

[3]CurrentPatentAssignee:SEALROCKTHERAPEUTICS-US2018/291002,2018,A1Locationinpatent:Paragraph0469;0471

[4]Yokokawa,Fumiaki;Nilar,Shahul;Noble,ChristianG.;Lim,SiewPheng;Rao,Ranga;Tania,Stefani;Wang,Gang;Lee,Gladys;Hunziker,Jürg;Karuna,Ratna;Manjunatha,Ujjini;Shi,Pei-Yong;Smith,PaulW.[JournalofMedicinalChemistry,2016,vol.59,#8,p.3935-3952]

[1]Yokokawa,Fumiaki;Nilar,Shahul;Noble,ChristianG.;Lim,SiewPheng;Rao,Ranga;Tania,Stefani;Wang,Gang;Lee,Gladys;Hunziker,Jürg;Karuna,Ratna;Manjunatha,Ujjini;Shi,Pei-Yong;Smith,PaulW.[JournalofMedicinalChemistry,2016,vol.59,#8,p.3935-3952]

[1]Yokokawa,Fumiaki;Nilar,Shahul;Noble,ChristianG.;Lim,SiewPheng;Rao,Ranga;Tania,Stefani;Wang,Gang;Lee,Gladys;Hunziker,Jürg;Karuna,Ratna;Manjunatha,Ujjini;Shi,Pei-Yong;Smith,PaulW.[JournalofMedicinalChemistry,2016,vol.59,#8,p.3935-3952]

[2]CurrentPatentAssignee:NAVITORPHARM;NAVITORPHARMACEUTICALS-US2018/127370,2018,A1

[3]CurrentPatentAssignee:SEALROCKTHERAPEUTICS-US2018/291002,2018,A1

[4]CurrentPatentAssignee:NANTONGUNIVERSITY-CN109053542,2018,A

1131587-94-4   
CASUnavailable 

[1]Yokokawa,Fumiaki;Nilar,Shahul;Noble,ChristianG.;Lim,SiewPheng;Rao,Ranga;Tania,Stefani;Wang,Gang;Lee,Gladys;Hunziker,Jürg;Karuna,Ratna;Manjunatha,Ujjini;Shi,Pei-Yong;Smith,PaulW.[JournalofMedicinalChemistry,2016,vol.59,#8,p.3935-3952]

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SDS
Tags:1131587-94-4 Molecular Formula|1131587-94-4 MDL|1131587-94-4 SMILES|1131587-94-4 Methyl 5-bromo-4-methoxy-2-methylbenzoate