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

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

CAS No.:
1874188-41-6
Catalog Number:
AG01ELM2
Molecular Formula:
C9H13ClN2O3
Molecular Weight:
232.6641
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Product Description
Catalog Number:
AG01ELM2
Chemical Name:
5-(piperidin-4-yl)-1,3-oxazole-4-carboxylic acid hydrochloride
CAS Number:
1874188-41-6
Molecular Formula:
C9H13ClN2O3
Molecular Weight:
232.6641
MDL Number:
MFCD31606681
IUPAC Name:
5-piperidin-4-yl-1,3-oxazole-4-carboxylic acid;hydrochloride
InChI:
InChI=1S/C9H12N2O3.ClH/c12-9(13)7-8(14-5-11-7)6-1-3-10-4-2-6;/h5-6,10H,1-4H2,(H,12,13);1H
InChI Key:
BISDVMJZLXEXJC-UHFFFAOYSA-N
SMILES:
OC(=O)c1ncoc1C1CCNCC1.Cl
Properties
Complexity:
216  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
232.061g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
232.664g/mol
Monoisotopic Mass:
232.061g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
75.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties