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159874-38-1 | 1-Piperidinecarboxylic acid, 4-(ethylamino)-, phenylmethyl ester
CAS No: 159874-38-1 Catalog No: AG001RGL MDL No:MFCD07772083
Product Description
Catalog Number:
AG001RGL
Chemical Name:
1-Piperidinecarboxylic acid, 4-(ethylamino)-, phenylmethyl ester
CAS Number:
159874-38-1
Molecular Formula:
C15H22N2O2
Molecular Weight:
262.3474
MDL Number:
MFCD07772083
IUPAC Name:
benzyl 4-(ethylamino)piperidine-1-carboxylate
InChI:
InChI=1S/C15H22N2O2/c1-2-16-14-8-10-17(11-9-14)15(18)19-12-13-6-4-3-5-7-13/h3-7,14,16H,2,8-12H2,1H3
InChI Key:
AGRCCDZHIDRWPM-UHFFFAOYSA-N
SMILES:
CCNC1CCN(CC1)C(=O)OCc1ccccc1
Properties
Complexity:
269
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.168g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
262.353g/mol
Monoisotopic Mass:
262.168g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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