Home Carboxys 3-(piperidin-4-yl)-1,2-oxazole-5-carboxylic acid

3-(piperidin-4-yl)-1,2-oxazole-5-carboxylic acid

CAS No.:
1523500-41-5
Catalog Number:
AG01B705
Molecular Formula:
C9H12N2O3
Molecular Weight:
196.2032
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Product Description
Catalog Number:
AG01B705
Chemical Name:
3-(piperidin-4-yl)-1,2-oxazole-5-carboxylic acid
CAS Number:
1523500-41-5
Molecular Formula:
C9H12N2O3
Molecular Weight:
196.2032
MDL Number:
MFCD26709848
IUPAC Name:
3-piperidin-4-yl-1,2-oxazole-5-carboxylic acid
InChI:
InChI=1S/C9H12N2O3/c12-9(13)8-5-7(11-14-8)6-1-3-10-4-2-6/h5-6,10H,1-4H2,(H,12,13)
InChI Key:
DNNTVGDEWNLNBT-UHFFFAOYSA-N
SMILES:
OC(=O)c1onc(c1)C1CCNCC1
Properties
Complexity:
216  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.085g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
196.206g/mol
Monoisotopic Mass:
196.085g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
75.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.9  
Properties