Home Carboxys ethyl 1-methyl-3-oxopiperidine-4-carboxylate hydrochloride

ethyl 1-methyl-3-oxopiperidine-4-carboxylate hydrochloride

CAS No.:
58020-12-5
Catalog Number:
AG01EJX2
Molecular Formula:
C9H16ClNO3
Molecular Weight:
221.6812
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Product Description
Catalog Number:
AG01EJX2
Chemical Name:
ethyl 1-methyl-3-oxopiperidine-4-carboxylate hydrochloride
CAS Number:
58020-12-5
Molecular Formula:
C9H16ClNO3
Molecular Weight:
221.6812
MDL Number:
MFCD31668257
IUPAC Name:
ethyl 1-methyl-3-oxopiperidine-4-carboxylate;hydrochloride
InChI:
InChI=1S/C9H15NO3.ClH/c1-3-13-9(12)7-4-5-10(2)6-8(7)11;/h7H,3-6H2,1-2H3;1H
InChI Key:
BRDLFCSQXDNVIR-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1CCN(CC1=O)C.Cl
Properties
Complexity:
215  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.082g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
221.681g/mol
Monoisotopic Mass:
221.082g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties