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478553-83-2,MFCD08064696
Catalog No.:AA00I8MX

478553-83-2 | 2-Methyl-4-nitro-1,3-benzoxazole

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$112.00   $78.00
- +
5g
98%
in stock  
$311.00   $218.00
- +
25g
98%
in stock  
$809.00   $567.00
- +
100g
98%
in stock  
$2,007.00 $1,405.00
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00I8MX
Chemical Name:
2-Methyl-4-nitro-1,3-benzoxazole
CAS Number:
478553-83-2
Molecular Formula:
C8H6N2O3
Molecular Weight:
178.1448
MDL Number:
MFCD08064696
SMILES:
Cc1oc2c(n1)c(ccc2)[N+](=O)[O-]
Properties
Computed Properties
 
Complexity:
216  
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:
4  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
0  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2  

Downstream Synthesis Route

[1]CurrentPatentAssignee:KyowaKirin(in:KirinHoldings);KIRINHOLDINGSCO.,LTD.-EP3712129,2020,A1Locationinpatent:Paragraph1326

[2]CurrentPatentAssignee:KASUMAPARTNERS-US2017/298081,2017,A1Locationinpatent:Paragraph0402;0405;0406

[3]Luo,Feihua;Yang,Jun;Li,Zhengkai;Xiang,Haifeng;Zhou,Xiangge[AdvancedSynthesisandCatalysis,2016,vol.358,#6,p.887-893]

[4]Phillips[JournaloftheChemicalSociety,1930,p.2685,2687]

[5]Sannie;Lapin[BulletindelaSocieteChimiquedeFrance,1952,p.369,371]MOLINE;WALKER;SCHWEIGERT[JournalofBiologicalChemistry,1959,vol.234,#4,p.880-883]

[1]CurrentPatentAssignee:BRISTOL-MYERSSQUIBBCO-US2004/77605,2004,A1CurrentPatentAssignee:BRISTOL-MYERSSQUIBBCO-US2005/119228,2005,A1

[2]CurrentPatentAssignee:KASUMAPARTNERS-US2017/298081,2017,A1Locationinpatent:Paragraph0402;0403;0404

[1]CurrentPatentAssignee:BRISTOL-MYERSSQUIBBCO-US2004/77605,2004,A1CurrentPatentAssignee:BRISTOL-MYERSSQUIBBCO-US2005/119228,2005,A1

[1]Luo,Feihua;Yang,Jun;Li,Zhengkai;Xiang,Haifeng;Zhou,Xiangge[AdvancedSynthesisandCatalysis,2016,vol.358,#6,p.887-893]

478553-83-2   
3-(4-(trifluoromethyl)phenyl)-N-(2-methylbenzodoxazol-4-yl)butanamide 

[1]Luo,Feihua;Yang,Jun;Li,Zhengkai;Xiang,Haifeng;Zhou,Xiangge[AdvancedSynthesisandCatalysis,2016,vol.358,#6,p.887-893]

Literature
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SDS
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Tags:478553-83-2 Molecular Formula|478553-83-2 MDL|478553-83-2 SMILES|478553-83-2 2-Methyl-4-nitro-1,3-benzoxazole
Catalog No.: AA00I8MX
478553-83-2,MFCD08064696
478553-83-2 | 2-Methyl-4-nitro-1,3-benzoxazole
Pack Size： 1g
Purity： 98%
in stock
$112.00 $78.00
Pack Size： 5g
Purity： 98%
in stock
$311.00 $218.00
Pack Size： 25g
Purity： 98%
in stock
$809.00 $567.00
Pack Size： 100g
Purity： 98%
in stock
$2,007.00 $1,405.00
Quantity
- +
Add to Card
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bulk Quotation Request
Technical Information
Catalog Number: AA00I8MX
Chemical Name: 2-Methyl-4-nitro-1,3-benzoxazole
CAS Number: 478553-83-2
Molecular Formula: C8H6N2O3
Molecular Weight: 178.1448
MDL Number: MFCD08064696
SMILES: Cc1oc2c(n1)c(ccc2)[N+](=O)[O-]
Properties
Complexity: 216  
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: 4  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 0  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2  
Downstream Synthesis Route
478553-83-2    342897-54-5 

[1]CurrentPatentAssignee:KyowaKirin(in:KirinHoldings);KIRINHOLDINGSCO.,LTD.-EP3712129,2020,A1Locationinpatent:Paragraph1326

[2]CurrentPatentAssignee:KASUMAPARTNERS-US2017/298081,2017,A1Locationinpatent:Paragraph0402;0405;0406

[3]Luo,Feihua;Yang,Jun;Li,Zhengkai;Xiang,Haifeng;Zhou,Xiangge[AdvancedSynthesisandCatalysis,2016,vol.358,#6,p.887-893]

[4]Phillips[JournaloftheChemicalSociety,1930,p.2685,2687]

[5]Sannie;Lapin[BulletindelaSocieteChimiquedeFrance,1952,p.369,371]MOLINE;WALKER;SCHWEIGERT[JournalofBiologicalChemistry,1959,vol.234,#4,p.880-883]

603-85-0    78-39-7    478553-83-2 

[1]CurrentPatentAssignee:BRISTOL-MYERSSQUIBBCO-US2004/77605,2004,A1CurrentPatentAssignee:BRISTOL-MYERSSQUIBBCO-US2005/119228,2005,A1

[2]CurrentPatentAssignee:KASUMAPARTNERS-US2017/298081,2017,A1Locationinpatent:Paragraph0402;0403;0404

478553-83-2    7439-89-6    342897-54-5 

[1]CurrentPatentAssignee:BRISTOL-MYERSSQUIBBCO-US2004/77605,2004,A1CurrentPatentAssignee:BRISTOL-MYERSSQUIBBCO-US2005/119228,2005,A1

603-85-0    122-51-0    478553-83-2 

[1]Luo,Feihua;Yang,Jun;Li,Zhengkai;Xiang,Haifeng;Zhou,Xiangge[AdvancedSynthesisandCatalysis,2016,vol.358,#6,p.887-893]

478553-83-2   
3-(4-(trifluoromethyl)phenyl)-N-(2-methylbenzodoxazol-4-yl)butanamide 

[1]Luo,Feihua;Yang,Jun;Li,Zhengkai;Xiang,Haifeng;Zhou,Xiangge[AdvancedSynthesisandCatalysis,2016,vol.358,#6,p.887-893]

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