Home Carboxys 2-Piperidinecarboxylicacid, 1-(phenylmethyl)-, ethyl ester

2-Piperidinecarboxylicacid, 1-(phenylmethyl)-, ethyl ester

CAS No.:
77034-34-5
Catalog Number:
AG005RCB
Molecular Formula:
C15H21NO2
Molecular Weight:
247.3327
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Product Description
Catalog Number:
AG005RCB
Chemical Name:
2-Piperidinecarboxylicacid, 1-(phenylmethyl)-, ethyl ester
CAS Number:
77034-34-5
Molecular Formula:
C15H21NO2
Molecular Weight:
247.3327
MDL Number:
MFCD01652570
IUPAC Name:
ethyl 1-benzylpiperidine-2-carboxylate
InChI:
InChI=1S/C15H21NO2/c1-2-18-15(17)14-10-6-7-11-16(14)12-13-8-4-3-5-9-13/h3-5,8-9,14H,2,6-7,10-12H2,1H3
InChI Key:
WCGHYUMBCGJLQB-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1CCCCN1Cc1ccccc1
Properties
Complexity:
261  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.157g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.338g/mol
Monoisotopic Mass:
247.157g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties