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306937-22-4 | 4-Piperidinecarboxylic acid, 1-[(3-aminophenyl)methyl]-, ethyl ester
CAS No: 306937-22-4 Catalog No: AG0030Y1 MDL No:MFCD02180894
Product Description
Catalog Number:
AG0030Y1
Chemical Name:
4-Piperidinecarboxylic acid, 1-[(3-aminophenyl)methyl]-, ethyl ester
CAS Number:
306937-22-4
Molecular Formula:
C15H22N2O2
Molecular Weight:
262.3474
MDL Number:
MFCD02180894
IUPAC Name:
ethyl 1-[(3-aminophenyl)methyl]piperidine-4-carboxylate
InChI:
InChI=1S/C15H22N2O2/c1-2-19-15(18)13-6-8-17(9-7-13)11-12-4-3-5-14(16)10-12/h3-5,10,13H,2,6-9,11,16H2,1H3
InChI Key:
WXYBQSXOZUFNJY-UHFFFAOYSA-N
SMILES:
CCOC(=O)C1CCN(CC1)Cc1cccc(c1)N
Properties
Complexity:
288
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:
4
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:
55.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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