Home Carboxys Ethyl isoxazole-3-carboxylate

Ethyl isoxazole-3-carboxylate

CAS No.:
3209-70-9
Catalog Number:
AG00C6P3
Molecular Formula:
C6H7NO3
Molecular Weight:
141.1247
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$25
- +
5g
98%
In Stock USA
United States
$75
- +
10g
98%
In Stock USA
United States
$138
- +
25g
98%
In Stock USA
United States
$250
- +
100g
98%
In Stock USA
United States
$800
- +
Product Description
Catalog Number:
AG00C6P3
Chemical Name:
Ethyl isoxazole-3-carboxylate
CAS Number:
3209-70-9
Molecular Formula:
C6H7NO3
Molecular Weight:
141.1247
MDL Number:
MFCD08234628
IUPAC Name:
ethyl 1,2-oxazole-3-carboxylate
InChI:
InChI=1S/C6H7NO3/c1-2-9-6(8)5-3-4-10-7-5/h3-4H,2H2,1H3
InChI Key:
RKXWKTOBQOSONL-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccon1
Properties
Complexity:
126  
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:
3  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Literature
Title Journal
Ethyl 4-{1-[(2,4-dinitro-phen-yl)hydrazono]eth-yl}-5-(2-naphthyl-methoxy-meth-yl)isoxazole-3-carboxyl-ate. Acta crystallographica. Section E, Structure reports online 20090101
Properties