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ethyl 3-amino-1-benzylpiperidine-4-carboxylate

ethyl 3-amino-1-benzylpiperidine-4-carboxylate

CAS: 1208359-69-6

Formula: C15H22N2O2

SMILES: CCOC(=O)C1CCN(CC2=CC=CC=C2)CC1N

IUPAC: ethyl 3-amino-1-benzylpiperidine-4-carboxylate

InChI: InChI=1/C15H22N2O2/c1-2-19-15(18)13-8-9-17(11-14(13)16)10-12-6-4-3-5-7-12/h3-7,13-14H,2,8-11,16H2,1H3

Composition: C (68.67%), H (8.45%), N (10.68%), O (12.20%)

Molar Mass: 262.353

Atom Count: 41

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 2
Exact Mass 262.168127956
Formal Charge 0
FSP3 0.53
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey HUJJKWSEEUDHJK-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 75.37
Topological Polar Surface Area 55.56
Polarizability 29.99
Ring Count 2
Rotatable Bond Count 5

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Purity LeadTime CAS PacketSize UnitPrice
96% <2 Days 1208359-69-6 $179.40-$4,597.70$179.40$243.80$373.75$631.35$1,147.70$4,597.70
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