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Home Carboxys Methyl 5-tert-butylisoxazole-3-carboxylate

Methyl 5-tert-butylisoxazole-3-carboxylate

CAS No.:
517870-22-3
Catalog Number:
AG00D848
Molecular Formula:
C9H13NO3
Molecular Weight:
183.2044
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$33
- +
250mg
95%
In Stock USA
United States
$58
- +
1g
95%
In Stock USA
United States
$148
- +
5g
95%
In Stock USA
United States
$437
- +
Product Description
Catalog Number:
AG00D848
Chemical Name:
Methyl 5-tert-butylisoxazole-3-carboxylate
CAS Number:
517870-22-3
Molecular Formula:
C9H13NO3
Molecular Weight:
183.2044
MDL Number:
MFCD03778975
IUPAC Name:
methyl 5-tert-butyl-1,2-oxazole-3-carboxylate
InChI:
InChI=1S/C9H13NO3/c1-9(2,3)7-5-6(10-13-7)8(11)12-4/h5H,1-4H3
InChI Key:
CQDWJFBDDMURCZ-UHFFFAOYSA-N
SMILES:
COC(=O)c1noc(c1)C(C)(C)C
Properties
Complexity:
198  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.09g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
183.207g/mol
Monoisotopic Mass:
183.09g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties