Home Carboxys Methyl 5-cyclopropylisoxazole-3-carboxylate

Methyl 5-cyclopropylisoxazole-3-carboxylate

CAS No.:
887360-91-0
Catalog Number:
AG003583
Molecular Formula:
C8H9NO3
Molecular Weight:
167.1620
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Purity
Availability
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Quantity
  
1g
>95%
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United States
$429
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Product Description
Catalog Number:
AG003583
Chemical Name:
Methyl 5-cyclopropylisoxazole-3-carboxylate
CAS Number:
887360-91-0
Molecular Formula:
C8H9NO3
Molecular Weight:
167.1620
MDL Number:
MFCD07390343
IUPAC Name:
methyl 5-cyclopropyl-1,2-oxazole-3-carboxylate
InChI:
InChI=1S/C8H9NO3/c1-11-8(10)6-4-7(12-9-6)5-2-3-5/h4-5H,2-3H2,1H3
InChI Key:
GLVAWJNBOCMLMP-UHFFFAOYSA-N
SMILES:
COC(=O)c1noc(c1)C1CC1
Properties
Complexity:
191  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.058g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
167.164g/mol
Monoisotopic Mass:
167.058g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties