Home Carboxys 5-(pyrrolidin-1-ylmethyl)-1,2-oxazole-3-carboxylic acid hydrochloride

5-(pyrrolidin-1-ylmethyl)-1,2-oxazole-3-carboxylic acid hydrochloride

CAS No.:
1803605-04-0
Catalog Number:
AG01AL6V
Molecular Formula:
C9H13ClN2O3
Molecular Weight:
232.6641
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Product Description
Catalog Number:
AG01AL6V
Chemical Name:
5-(pyrrolidin-1-ylmethyl)-1,2-oxazole-3-carboxylic acid hydrochloride
CAS Number:
1803605-04-0
Molecular Formula:
C9H13ClN2O3
Molecular Weight:
232.6641
MDL Number:
MFCD28954268
IUPAC Name:
5-(pyrrolidin-1-ylmethyl)-1,2-oxazole-3-carboxylic acid;hydrochloride
InChI:
InChI=1S/C9H12N2O3.ClH/c12-9(13)8-5-7(14-10-8)6-11-3-1-2-4-11;/h5H,1-4,6H2,(H,12,13);1H
InChI Key:
RMRFKHBLLVSCRH-UHFFFAOYSA-N
SMILES:
OC(=O)c1noc(c1)CN1CCCC1.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:
2  
Isotope Atom Count:
0
Molecular Weight:
232.664g/mol
Monoisotopic Mass:
232.061g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
66.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties