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1004-96-2,MFCD10699057
Catalog No.:AA0001TQ
1004-96-2 | Methyl 3-methylisoxazole-5-carboxylate
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Purity
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Price(USD)
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100mg
95%
in stock  
$37.00   $26.00
- +
250mg
95%
in stock  
$62.00   $43.00
- +
1g
95%
in stock  
$123.00   $86.00
- +
5g
95%
in stock  
$367.00   $257.00
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  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Q & A
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA0001TQ
Chemical Name:
Methyl 3-methylisoxazole-5-carboxylate
CAS Number:
1004-96-2
Molecular Formula:
C6H7NO3
Molecular Weight:
141.1247
MDL Number:
MFCD10699057
IUPAC Name:
methyl 3-methyl-1,2-oxazole-5-carboxylate
InChI:
InChI=1S/C6H7NO3/c1-4-3-5(10-7-4)6(8)9-2/h3H,1-2H3
InChI Key:
MBRNUSBFRMCWIZ-UHFFFAOYSA-N
SMILES:
COC(=O)c1onc(c1)C
EC Number:
213-730-1
Properties
Computed Properties
 
Complexity:
137  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
141.043g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
141.126g/mol
Monoisotopic Mass:
141.043g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  

Synonyms
 
Methyl 3-methylisoxazole-5-carboxylate 
1004-96-2 
KS-00000PNS 
DTXSID10143250 
MBRNUSBFRMCWIZ-UHFFFAOYSA-N 
ZINC2004541 
0210AA 
ANW-56878 
MFCD10699057 
SBB026808 
STK510221 
AKOS005168730 
5-isoxazolecarboxylic acid, 3-methyl-, methyl ester 
methyl 3-methyl-5-isoxazolecarboxylate 
MCULE-1514161202 
AJ-32441 
AK-99990 
DS-17778 
TC-145623 
CS-0035753 
ST24025305 
ST45135563 
3-Methyl-5-isoxazolecarboxylic acid methyl ester 
methyl 3-methyl-1,2-oxazole-5-carboxylate 
3-Methylisoxazole-5-carboxylic acid methyl ester 
3-methyl-isoxazole-5-carboxylic acid methyl ester 
AN-970/40211557 
I14-13711 
7233-69-4 
C6H7NO3 
C6-H7-N-O3 
CID70492 
AR-1G8637 
7509-28-6 
5-Isoxazolecarboxylicacid, 3-methyl-, methyl ester 
EINECS 213-730-1 
AC1Q5ZFE 
AC1L2E7E 
SCHEMBL4034128 
CTK3J9008 
Literature
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