Home Carboxys 5-cyclobutyl-1,2-oxazole-4-carboxylic acid

5-cyclobutyl-1,2-oxazole-4-carboxylic acid

CAS No.:
1785112-48-2
Catalog Number:
AG01EKPC
Molecular Formula:
C8H9NO3
Molecular Weight:
167.1620
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Product Description
Catalog Number:
AG01EKPC
Chemical Name:
5-cyclobutyl-1,2-oxazole-4-carboxylic acid
CAS Number:
1785112-48-2
Molecular Formula:
C8H9NO3
Molecular Weight:
167.1620
MDL Number:
MFCD31666464
IUPAC Name:
5-cyclobutyl-1,2-oxazole-4-carboxylic acid
InChI:
InChI=1S/C8H9NO3/c10-8(11)6-4-9-12-7(6)5-2-1-3-5/h4-5H,1-3H2,(H,10,11)
InChI Key:
GIWOUAPBYZJDHV-UHFFFAOYSA-N
SMILES:
OC(=O)c1cnoc1C1CCC1
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:
1  
Isotope Atom Count:
0
Molecular Weight:
167.164g/mol
Monoisotopic Mass:
167.058g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties