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19776-98-8,MFCD00613415
Catalog No.:AA002AX2

19776-98-8 | N-Methyl-1,3-benzoxazol-2-amine

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100mg
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$193.00   $135.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA002AX2
Chemical Name:
N-Methyl-1,3-benzoxazol-2-amine
CAS Number:
19776-98-8
Molecular Formula:
C8H8N2O
Molecular Weight:
148.1619
MDL Number:
MFCD00613415
SMILES:
CNc1nc2c(o1)cccc2
Properties
Properties
 
Form:
Solid  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
140  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
1.8  

Downstream Synthesis Route

[1]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-US6699879,2004,B1Locationinpatent:Page/Pagecolumn24-25

[1]Wang,Rui;Liu,Hong;Yue,Liang;Zhang,Xiao-Ke;Tan,Qiu-Yuan;Pan,Ruo-Lin[TetrahedronLetters,2014,vol.55,#14,p.2233-2237]

[2]Wang,Jian;Hou,Ji-Ting;Wen,Jun;Zhang,Ji;Yu,Xiao-Qi[ChemicalCommunications,2011,vol.47,#12,p.3652-3654]

[1]OrganicLetters,2017,vol.19,p.5790-5793

[2]Organometallics,2018,vol.37,p.3353-3359

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

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SDS
Tags:19776-98-8 Molecular Formula|19776-98-8 MDL|19776-98-8 SMILES|19776-98-8 N-Methyl-1,3-benzoxazol-2-amine