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41994-97-2,MFCD30474679
Catalog No.:AA00I837

41994-97-2 | 7-Methoxy-3H-1,2,3-benzotriazin-4-one

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$112.00   $78.00
- +
5g
98%
in stock  
$311.00   $218.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00I837
Chemical Name:
7-Methoxy-3H-1,2,3-benzotriazin-4-one
CAS Number:
41994-97-2
Molecular Formula:
C8H7N3O2
Molecular Weight:
177.1601
MDL Number:
MFCD30474679
SMILES:
COc1ccc2c(c1)nn[nH]c2=O
Properties
Computed Properties
 
Complexity:
242  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
1.4  

Downstream Synthesis Route

[1]Archer,JohnG.;Barker,AlanJ.;Smalley,RobertK.[JournaloftheChemicalSociety.PerkintransactionsI,1973,p.1169-1173]

[1]Grundmann;Ulrich[JournalofOrganicChemistry,1959,vol.24,p.272]

methyl2-(4-bromophenyl)sulfanyl-4-hydroxybutanoate 
  41994-97-2    1369800-55-4 

[1]CurrentPatentAssignee:SUNPHARMACEUTICALINDUSTRIESLIMITED-WO2012/38942,2012,A1Locationinpatent:Page/Pagecolumn49

[2]CurrentPatentAssignee:SUNPHARMACEUTICALINDUSTRIESLIMITED-US2014/148459,2014,A1Locationinpatent:Paragraph0423;0424

Literature
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SDS
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