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206273-87-2

206273-87-2 | 1-Piperidinecarboxylic acid, 4-[(phenylmethyl)amino]-, 1,1-dimethylethyl ester

CAS No: 206273-87-2 Catalog No: AG002IEO MDL No:MFCD04114987

Product Description

Catalog Number:
AG002IEO
Chemical Name:
1-Piperidinecarboxylic acid, 4-[(phenylmethyl)amino]-, 1,1-dimethylethyl ester
CAS Number:
206273-87-2
Molecular Formula:
C17H26N2O2
Molecular Weight:
290.4005
MDL Number:
MFCD04114987
IUPAC Name:
tert-butyl 4-(benzylamino)piperidine-1-carboxylate
InChI:
InChI=1S/C17H26N2O2/c1-17(2,3)21-16(20)19-11-9-15(10-12-19)18-13-14-7-5-4-6-8-14/h4-8,15,18H,9-13H2,1-3H3
InChI Key:
IUJZIXJMTQNFOG-UHFFFAOYSA-N
SMILES:
O=C(N1CCC(CC1)NCc1ccccc1)OC(C)(C)C

Properties

Complexity:
324  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.199g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
290.407g/mol
Monoisotopic Mass:
290.199g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  

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