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benzyl 4-(2-chloroacetyl)piperidine-1-carboxylate

benzyl 4-(2-chloroacetyl)piperidine-1-carboxylate

CAS: 85475-10-1

Formula: C15H18ClNO3

SMILES: ClCC(=O)C1CCN(CC1)C(=O)OCC1=CC=CC=C1

IUPAC: benzyl 4-(2-chloroacetyl)piperidine-1-carboxylate

InChI: InChI=1S/C15H18ClNO3/c16-10-14(18)13-6-8-17(9-7-13)15(19)20-11-12-4-2-1-3-5-12/h1-5,13H,6-11H2

Composition: C (60.92%), H (6.13%), Cl (11.99%), N (4.74%), O (16.23%)

Molar Mass: 295.76

Atom Count: 38

Heavy Atom Count: 20

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 295.0975211
Formal Charge 0
FSP3 0.47
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey BTFDQROQQVEQQD-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 77.18
Topological Polar Surface Area 46.61
Polarizability 30
Ring Count 2
Rotatable Bond Count 5

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