944317-92-4,MFCD15528104
Catalog No.:AA00II31

944317-92-4 | 1-Bromo-4-fluoro-5-isopropyl-2-methoxybenzene

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
95%
in stock  
$38.00   $27.00
- +
5g
98%
in stock  
$170.00   $119.00
- +
10g
98%
in stock  
$266.00   $186.00
- +
25g
98%
in stock  
$631.00 $442.00
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00II31
Chemical Name:
1-Bromo-4-fluoro-5-isopropyl-2-methoxybenzene
CAS Number:
944317-92-4
Molecular Formula:
C10H12BrFO
Molecular Weight:
247.1041
MDL Number:
MFCD15528104
SMILES:
COc1cc(F)c(cc1Br)C(C)C
Properties
Computed Properties
 
Complexity:
163  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
3.8  

Upstream Synthesis Route

[1]Patent:WO2012/85133,2012,A1,.Locationinpatent:Page/Pagecolumn45-46

[1]Patent:EP2468735,2012,A1,.Locationinpatent:Page/Pagecolumn34

[2]Patent:WO2013/91696,2013,A1,.Locationinpatent:Page/Pagecolumn41

[3]Patent:CN106083536,2016,A,.Locationinpatent:Paragraph0047;0048

[1]Patent:WO2013/91696,2013,A1,.Locationinpatent:Page/Pagecolumn38

[2]JournalofOrganicChemistry,2011,vol.76,#5,p.1436-1439

[3]Patent:EP2468735,2012,A1,.Locationinpatent:Page/Pagecolumn32

[4]Patent:EP2468735,2012,A1,

[5]Patent:WO2013/91696,2013,A1,

[1]Patent:EP2468735,2012,A1,

[2]Patent:EP2468736,2012,A1,

[3]Patent:EP2468735,2012,A1,

[4]Patent:EP2468735,2012,A1,

[5]Patent:WO2012/85133,2012,A1,

[6]Patent:WO2012/85133,2012,A1,

[7]Patent:WO2012/85133,2012,A1,

[8]Patent:WO2013/66768,2013,A1,

[9]Patent:WO2013/91696,2013,A1,

[10]Patent:WO2013/91696,2013,A1,

[11]Patent:WO2013/91696,2013,A1,

[12]Patent:US2014/303380,2014,A1,

[13]Patent:CN107365324,2017,A,

[1]Patent:EP2468735,2012,A1,

[2]Patent:EP2468736,2012,A1,

[3]Patent:EP2468735,2012,A1,

[4]Patent:EP2468735,2012,A1,

[5]Patent:WO2012/85133,2012,A1,

[6]Patent:WO2013/66768,2013,A1,

[7]Patent:WO2013/91696,2013,A1,

[8]Patent:WO2013/91696,2013,A1,

[9]Patent:WO2013/91696,2013,A1,

[10]Patent:US2014/303380,2014,A1,

Downstream Synthesis Route

[1]Patent:WO2007/5572,2007,A1.Locationinpatent:Page/Pagecolumn7-8

[2]Patent:WO2007/92642,2007,A2.Locationinpatent:Page/Pagecolumn20-21

[1]JournalofOrganicChemistry,2011,vol.76,p.1436-1439

[2]Patent:EP2468735,2012,A1

[3]Patent:EP2468735,2012,A1

[4]Patent:WO2013/91696,2013,A1

[5]Patent:WO2013/91696,2013,A1

[6]Patent:CN106083536,2016,A

[1]CurrentPatentAssignee:BETTAPHARMACEUTICALSCOLTD-WO2012/41253,2012,A1Locationinpatent:Page/Pagecolumn17

[1]CurrentPatentAssignee:NOVARTISAG;Sandoz(in:Novartis)-EP2468736,2012,A1Locationinpatent:Page/Pagecolumn44

[2]CurrentPatentAssignee:NOVARTISAG;Sandoz(in:Novartis)-WO2012/85133,2012,A1Locationinpatent:Page/Pagecolumn48

[1]CurrentPatentAssignee:NOVARTISAG;Sandoz(in:Novartis)-EP2468736,2012,A1

[2]CurrentPatentAssignee:NOVARTISAG;Sandoz(in:Novartis)-EP2468736,2012,A1

[3]CurrentPatentAssignee:Sandoz(in:Novartis);NOVARTISAG-EP2468735,2012,A1

[4]CurrentPatentAssignee:Sandoz(in:Novartis);NOVARTISAG-EP2468735,2012,A1

[5]CurrentPatentAssignee:NOVARTISAG;Sandoz(in:Novartis)-WO2012/85133,2012,A1

[6]CurrentPatentAssignee:MERCK&COINC-WO2013/66768,2013,A1

[7]CurrentPatentAssignee:NOVARTISAG;Sandoz(in:Novartis)-WO2013/91696,2013,A1

[8]CurrentPatentAssignee:NOVARTISAG;Sandoz(in:Novartis)-WO2013/91696,2013,A1

[9]CurrentPatentAssignee:NOVARTISAG;Sandoz(in:Novartis)-WO2013/91696,2013,A1

[10]CurrentPatentAssignee:NOVARTISAG;Sandoz(in:Novartis)-WO2013/91696,2013,A1

[11]CurrentPatentAssignee:NOVARTISAG;Sandoz(in:Novartis)-WO2013/91696,2013,A1

[12]CurrentPatentAssignee:MERCK&COINC-US2014/303380,2014,A1

[13]CurrentPatentAssignee:MERCK&COINC-US2014/303380,2014,A1

Literature
Quotation Request
Company Name:
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Contact Person:
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Email:
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Quantity Required:
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Additional Info:
SDS
Tags:944317-92-4 Molecular Formula|944317-92-4 MDL|944317-92-4 SMILES|944317-92-4 1-Bromo-4-fluoro-5-isopropyl-2-methoxybenzene
Catalog No.: AA00II31
944317-92-4,MFCD15528104
944317-92-4 | 1-Bromo-4-fluoro-5-isopropyl-2-methoxybenzene
Pack Size: 1g
Purity: 95%
in stock
$38.00 $27.00
Pack Size: 5g
Purity: 98%
in stock
$170.00 $119.00
Pack Size: 10g
Purity: 98%
in stock
$266.00 $186.00
Pack Size: 25g
Purity: 98%
in stock
$631.00 $442.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00II31
Chemical Name: 1-Bromo-4-fluoro-5-isopropyl-2-methoxybenzene
CAS Number: 944317-92-4
Molecular Formula: C10H12BrFO
Molecular Weight: 247.1041
MDL Number: MFCD15528104
SMILES: COc1cc(F)c(cc1Br)C(C)C
Properties
Complexity: 163  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 13  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 3.8  
Upstream Synthesis Route
875446-55-2    96826-25-4    944317-92-4 

[1]Patent:WO2012/85133,2012,A1,.Locationinpatent:Page/Pagecolumn45-46

1383814-82-1    944317-92-4 

[1]Patent:EP2468735,2012,A1,.Locationinpatent:Page/Pagecolumn34

[2]Patent:WO2013/91696,2013,A1,.Locationinpatent:Page/Pagecolumn41

[3]Patent:CN106083536,2016,A,.Locationinpatent:Paragraph0047;0048

958029-46-4    944317-92-4 

[1]Patent:WO2013/91696,2013,A1,.Locationinpatent:Page/Pagecolumn38

[2]JournalofOrganicChemistry,2011,vol.76,#5,p.1436-1439

[3]Patent:EP2468735,2012,A1,.Locationinpatent:Page/Pagecolumn32

[4]Patent:EP2468735,2012,A1,

[5]Patent:WO2013/91696,2013,A1,

74457-86-6    944317-92-4 

[1]Patent:EP2468735,2012,A1,

[2]Patent:EP2468736,2012,A1,

[3]Patent:EP2468735,2012,A1,

[4]Patent:EP2468735,2012,A1,

[5]Patent:WO2012/85133,2012,A1,

[6]Patent:WO2012/85133,2012,A1,

[7]Patent:WO2012/85133,2012,A1,

[8]Patent:WO2013/66768,2013,A1,

[9]Patent:WO2013/91696,2013,A1,

[10]Patent:WO2013/91696,2013,A1,

[11]Patent:WO2013/91696,2013,A1,

[12]Patent:US2014/303380,2014,A1,

[13]Patent:CN107365324,2017,A,

96826-25-4    944317-92-4 

[1]Patent:EP2468735,2012,A1,

[2]Patent:EP2468736,2012,A1,

[3]Patent:EP2468735,2012,A1,

[4]Patent:EP2468735,2012,A1,

[5]Patent:WO2012/85133,2012,A1,

[6]Patent:WO2013/66768,2013,A1,

[7]Patent:WO2013/91696,2013,A1,

[8]Patent:WO2013/91696,2013,A1,

[9]Patent:WO2013/91696,2013,A1,

[10]Patent:US2014/303380,2014,A1,

Downstream Synthesis Route
944317-92-4    875446-29-0 

[1]Patent:WO2007/5572,2007,A1.Locationinpatent:Page/Pagecolumn7-8

[2]Patent:WO2007/92642,2007,A2.Locationinpatent:Page/Pagecolumn20-21

450-88-4    944317-92-4 

[1]JournalofOrganicChemistry,2011,vol.76,p.1436-1439

[2]Patent:EP2468735,2012,A1

[3]Patent:EP2468735,2012,A1

[4]Patent:WO2013/91696,2013,A1

[5]Patent:WO2013/91696,2013,A1

[6]Patent:CN106083536,2016,A

944317-92-4    1072951-42-8    1370452-47-3 

[1]CurrentPatentAssignee:BETTAPHARMACEUTICALSCOLTD-WO2012/41253,2012,A1Locationinpatent:Page/Pagecolumn17

944317-92-4    454-92-2    1061715-95-4 

[1]CurrentPatentAssignee:NOVARTISAG;Sandoz(in:Novartis)-EP2468736,2012,A1Locationinpatent:Page/Pagecolumn44

[2]CurrentPatentAssignee:NOVARTISAG;Sandoz(in:Novartis)-WO2012/85133,2012,A1Locationinpatent:Page/Pagecolumn48

944317-92-4    875446-37-0 

[1]CurrentPatentAssignee:NOVARTISAG;Sandoz(in:Novartis)-EP2468736,2012,A1

[2]CurrentPatentAssignee:NOVARTISAG;Sandoz(in:Novartis)-EP2468736,2012,A1

[3]CurrentPatentAssignee:Sandoz(in:Novartis);NOVARTISAG-EP2468735,2012,A1

[4]CurrentPatentAssignee:Sandoz(in:Novartis);NOVARTISAG-EP2468735,2012,A1

[5]CurrentPatentAssignee:NOVARTISAG;Sandoz(in:Novartis)-WO2012/85133,2012,A1

[6]CurrentPatentAssignee:MERCK&COINC-WO2013/66768,2013,A1

[7]CurrentPatentAssignee:NOVARTISAG;Sandoz(in:Novartis)-WO2013/91696,2013,A1

[8]CurrentPatentAssignee:NOVARTISAG;Sandoz(in:Novartis)-WO2013/91696,2013,A1

[9]CurrentPatentAssignee:NOVARTISAG;Sandoz(in:Novartis)-WO2013/91696,2013,A1

[10]CurrentPatentAssignee:NOVARTISAG;Sandoz(in:Novartis)-WO2013/91696,2013,A1

[11]CurrentPatentAssignee:NOVARTISAG;Sandoz(in:Novartis)-WO2013/91696,2013,A1

[12]CurrentPatentAssignee:MERCK&COINC-US2014/303380,2014,A1

[13]CurrentPatentAssignee:MERCK&COINC-US2014/303380,2014,A1

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