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2510-36-3,MFCD00051657
Catalog No.:AA002QE9

2510-36-3 | 3,5-Dimethylisoxazole-4-carboxylic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$19.00   $14.00
- +
5g
98%
in stock  
$24.00   $17.00
- +
25g
98%
in stock  
$55.00   $39.00
- +
100g
98%
in stock  
$218.00   $153.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA002QE9
Chemical Name:
3,5-Dimethylisoxazole-4-carboxylic acid
CAS Number:
2510-36-3
Molecular Formula:
C6H7NO3
Molecular Weight:
141.1247
MDL Number:
MFCD00051657
SMILES:
OC(=O)c1c(C)noc1C
Properties
Properties
 
BP:
301.8°C at 760 mmHg  
Form:
Solid  
MP:
141-145 °C(lit.)  
Refractive Index:
1.4890 (estimate)  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
148  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
0.7  

Upstream Synthesis Route

[1]BioorganicandMedicinalChemistryLetters,2018,vol.28,#17,p.2879-2884

[2]JustusLiebigsAnnalenderChemie,1893,vol.277,p.174

[3]JournaloftheAmericanChemicalSociety,1967,vol.89,p.5461-5462

[1]ZhurnalObshcheiKhimii,1958,vol.28,p.2736,2743;engl.Ausg.S.2762,2768

[2]ZhurnalObshcheiKhimii,1958,vol.28,p.2736,2743;engl.Ausg.S.2762,2768

[1]ZhurnalObshcheiKhimii,1958,vol.28,p.2736,2743;engl.Ausg.S.2762,2768

[2]ZhurnalObshcheiKhimii,1958,vol.28,p.2736,2743;engl.Ausg.S.2762,2768

[1]ZhurnalObshcheiKhimii,1958,vol.28,p.2736,2743;engl.Ausg.S.2762,2768

[1]J.Gen.Chem.USSR(Engl.Transl.),1963,vol.33,p.1170-1173

[2]ZhurnalObshcheiKhimii,1963,vol.33,p.1192-1196

Downstream Synthesis Route

[1]BioorganicandMedicinalChemistryLetters,2018,vol.28,p.2879-2884

[2]JustusLiebigsAnnalenderChemie,1893,vol.277,p.174

[3]JournaloftheAmericanChemicalSociety,1967,vol.89,p.5461-5462

[1]JournalofOrganicChemistry,1985,vol.50,p.5660-5666

[1]Heterocycles,1990,vol.31,p.327-339

[1]JournalofOrganicChemistry,1990,vol.55,p.4011-4019

[1]JournalofOrganicChemistry,1985,vol.50,p.5660-5666

Literature

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

Journal: Bioorganic & medicinal chemistry letters 20101101

Quotation Request
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SDS
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Tags:2510-36-3 Molecular Formula|2510-36-3 MDL|2510-36-3 SMILES|2510-36-3 3,5-Dimethylisoxazole-4-carboxylic acid
Catalog No.: AA002QE9
2510-36-3,MFCD00051657
2510-36-3 | 3,5-Dimethylisoxazole-4-carboxylic acid
Pack Size： 1g
Purity： 98%
in stock
$19.00 $14.00
Pack Size： 5g
Purity： 98%
in stock
$24.00 $17.00
Pack Size： 25g
Purity： 98%
in stock
$55.00 $39.00
Pack Size： 100g
Purity： 98%
in stock
$218.00 $153.00
Quantity
- +
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Technical Information
Catalog Number: AA002QE9
Chemical Name: 3,5-Dimethylisoxazole-4-carboxylic acid
CAS Number: 2510-36-3
Molecular Formula: C6H7NO3
Molecular Weight: 141.1247
MDL Number: MFCD00051657
SMILES: OC(=O)c1c(C)noc1C
Properties
BP: 301.8°C at 760 mmHg  
Form: Solid  
MP: 141-145 °C(lit.)  
Refractive Index: 1.4890 (estimate)  
Storage: Keep in dry area;Room Temperature;  
Complexity: 148  
Covalently-Bonded Unit Count: 1  
Heavy Atom Count: 10  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 1  
Rotatable Bond Count: 1  
XLogP3: 0.7  
Upstream Synthesis Route
17147-42-1    2510-36-3 

[1]BioorganicandMedicinalChemistryLetters,2018,vol.28,#17,p.2879-2884

[2]JustusLiebigsAnnalenderChemie,1893,vol.277,p.174

[3]JournaloftheAmericanChemicalSociety,1967,vol.89,p.5461-5462

19788-37-5    2510-36-3 

[1]ZhurnalObshcheiKhimii,1958,vol.28,p.2736,2743;engl.Ausg.S.2762,2768

[2]ZhurnalObshcheiKhimii,1958,vol.28,p.2736,2743;engl.Ausg.S.2762,2768

300-87-8    2510-36-3 

[1]ZhurnalObshcheiKhimii,1958,vol.28,p.2736,2743;engl.Ausg.S.2762,2768

[2]ZhurnalObshcheiKhimii,1958,vol.28,p.2736,2743;engl.Ausg.S.2762,2768

19788-36-4    2510-36-3 

[1]ZhurnalObshcheiKhimii,1958,vol.28,p.2736,2743;engl.Ausg.S.2762,2768

10557-82-1    2510-36-3 

[1]J.Gen.Chem.USSR(Engl.Transl.),1963,vol.33,p.1170-1173

[2]ZhurnalObshcheiKhimii,1963,vol.33,p.1192-1196

Downstream Synthesis Route
17147-42-1    2510-36-3 

[1]BioorganicandMedicinalChemistryLetters,2018,vol.28,p.2879-2884

[2]JustusLiebigsAnnalenderChemie,1893,vol.277,p.174

[3]JournaloftheAmericanChemicalSociety,1967,vol.89,p.5461-5462

2510-36-3    111-83-1    99299-03-3 

[1]JournalofOrganicChemistry,1985,vol.50,p.5660-5666

2510-36-3    2853-29-4    129413-66-7 

[1]Heterocycles,1990,vol.31,p.327-339

2510-36-3    917-54-4    35166-20-2 

[1]JournalofOrganicChemistry,1990,vol.55,p.4011-4019

2510-36-3    100-39-0    99299-02-2 

[1]JournalofOrganicChemistry,1985,vol.50,p.5660-5666

Literature fold

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

Journal: Bioorganic & medicinal chemistry letters20101101

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