Home Carboxys 5-Ethyl-isoxazole-4-carboxylic acid

5-Ethyl-isoxazole-4-carboxylic acid

CAS No.:
134541-03-0
Catalog Number:
AG0070DJ
Molecular Formula:
C6H7NO3
Molecular Weight:
141.1247
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$448
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Product Description
Catalog Number:
AG0070DJ
Chemical Name:
5-Ethyl-isoxazole-4-carboxylic acid
CAS Number:
134541-03-0
Molecular Formula:
C6H7NO3
Molecular Weight:
141.1247
MDL Number:
MFCD07357474
IUPAC Name:
5-ethyl-1,2-oxazole-4-carboxylic acid
InChI:
InChI=1S/C6H7NO3/c1-2-5-4(6(8)9)3-7-10-5/h3H,2H2,1H3,(H,8,9)
InChI Key:
YGUUMRJFLRVBOD-UHFFFAOYSA-N
SMILES:
CCc1oncc1C(=O)O
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:
1  
Isotope Atom Count:
0
Molecular Weight:
141.126g/mol
Monoisotopic Mass:
141.043g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7  
Properties