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1243281-23-3,MFCD16998697
Catalog No.:AA000LSD

1243281-23-3 | 3-Hydroxy-2-methoxybenzonitrile

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
98%
1 week  
$51.00   $36.00
- +
250mg
98%
1 week  
$80.00   $56.00
- +
1g
98%
1 week  
$214.00   $150.00
- +
5g
98%
1 week  
$859.00   $602.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA000LSD
Chemical Name:
3-Hydroxy-2-methoxybenzonitrile
CAS Number:
1243281-23-3
Molecular Formula:
C8H7NO2
Molecular Weight:
149.1467
MDL Number:
MFCD16998697
SMILES:
COc1c(C#N)cccc1O
Properties
Computed Properties
 
Complexity:
172  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.3  

Downstream Synthesis Route
22536-67-0   
3-hydroxy-2-methoxybenzonitrile 
 
3-(5-chloro-2-pyrimidinyl)oxy-2-methoxybenzonitrile 

[1]Patent:WO2016/10731,2016,A1.Locationinpatent:Page/Pagecolumn30;31

[2]Patent:WO2017/11288,2017,A1.Locationinpatent:Page/Pagecolumn28

[1]CurrentPatentAssignee:FMCCORP-WO2016/10731,2016,A1

[1]CurrentPatentAssignee:FMCCORP-WO2016/10731,2016,A1

[2]CurrentPatentAssignee:FMCCORP-WO2017/11288,2017,A1

[1]CurrentPatentAssignee:FMCCORP-WO2017/11288,2017,A1

1243281-23-3   
CASUnavailable 

[1]Luise,Chiara;Robaa,Dina;Regenass,Pierre;Maurer,David;Ostrovskyi,Dmytro;Seifert,Ludwig;Bacher,Johannes;Burgahn,Teresa;Wagner,Tobias;Seitz,Johannes;Greschik,Holger;Park,Kwang-Su;Xiong,Yan;Jin,Jian;Schüle,Roland;Breit,Bernhard;Jung,Manfred;Sippl,Wolfgang[InternationalJournalofMolecularSciences,2021,vol.22,#11]

Literature
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SDS
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Tags:1243281-23-3 Molecular Formula|1243281-23-3 MDL|1243281-23-3 SMILES|1243281-23-3 3-Hydroxy-2-methoxybenzonitrile
Catalog No.: AA000LSD
1243281-23-3,MFCD16998697
1243281-23-3 | 3-Hydroxy-2-methoxybenzonitrile
Pack Size： 100mg
Purity： 98%
1 week
$51.00 $36.00
Pack Size： 250mg
Purity： 98%
1 week
$80.00 $56.00
Pack Size： 1g
Purity： 98%
1 week
$214.00 $150.00
Pack Size： 5g
Purity： 98%
1 week
$859.00 $602.00
Quantity
- +
Add to Card
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bulk Quotation Request
Technical Information
Catalog Number: AA000LSD
Chemical Name: 3-Hydroxy-2-methoxybenzonitrile
CAS Number: 1243281-23-3
Molecular Formula: C8H7NO2
Molecular Weight: 149.1467
MDL Number: MFCD16998697
SMILES: COc1c(C#N)cccc1O
Properties
Complexity: 172  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 11  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.3  
Downstream Synthesis Route
22536-67-0   
3-hydroxy-2-methoxybenzonitrile 
 
3-(5-chloro-2-pyrimidinyl)oxy-2-methoxybenzonitrile 

[1]Patent:WO2016/10731,2016,A1.Locationinpatent:Page/Pagecolumn30;31

[2]Patent:WO2017/11288,2017,A1.Locationinpatent:Page/Pagecolumn28

1243281-23-3    1855850-87-1 

[1]CurrentPatentAssignee:FMCCORP-WO2016/10731,2016,A1

1243281-23-3    1855851-31-8 

[1]CurrentPatentAssignee:FMCCORP-WO2016/10731,2016,A1

[2]CurrentPatentAssignee:FMCCORP-WO2017/11288,2017,A1

1243281-23-3    2068103-86-4 

[1]CurrentPatentAssignee:FMCCORP-WO2017/11288,2017,A1

1243281-23-3   
CASUnavailable 

[1]Luise,Chiara;Robaa,Dina;Regenass,Pierre;Maurer,David;Ostrovskyi,Dmytro;Seifert,Ludwig;Bacher,Johannes;Burgahn,Teresa;Wagner,Tobias;Seitz,Johannes;Greschik,Holger;Park,Kwang-Su;Xiong,Yan;Jin,Jian;Schüle,Roland;Breit,Bernhard;Jung,Manfred;Sippl,Wolfgang[InternationalJournalofMolecularSciences,2021,vol.22,#11]

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