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1262412-22-5 | 1-Piperidinecarboxylic acid, 4-amino-4-(hydroxymethyl)-, phenylmethyl ester
CAS No: 1262412-22-5 Catalog No: AG000SEX MDL No:MFCD18375146
Product Description
Catalog Number:
AG000SEX
Chemical Name:
1-Piperidinecarboxylic acid, 4-amino-4-(hydroxymethyl)-, phenylmethyl ester
CAS Number:
1262412-22-5
Molecular Formula:
C14H20N2O3
Molecular Weight:
264.3202
MDL Number:
MFCD18375146
IUPAC Name:
benzyl 4-amino-4-(hydroxymethyl)piperidine-1-carboxylate
InChI:
InChI=1S/C14H20N2O3/c15-14(11-17)6-8-16(9-7-14)13(18)19-10-12-4-2-1-3-5-12/h1-5,17H,6-11,15H2
InChI Key:
GRNDNKZYKHELLX-UHFFFAOYSA-N
SMILES:
OCC1(N)CCN(CC1)C(=O)OCc1ccccc1
Properties
Complexity:
295
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.147g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
264.325g/mol
Monoisotopic Mass:
264.147g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
75.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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