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methyl 1-(4-chlorobenzoyl)piperidine-4-carboxylate

methyl 1-(4-chlorobenzoyl)piperidine-4-carboxylate

Formula: C14H16ClNO3

SMILES: COC(=O)C1CCN(CC1)C(=O)C1=CC=C(Cl)C=C1

IUPAC: methyl 1-(4-chlorobenzoyl)piperidine-4-carboxylate

InChI: InChI=1S/C14H16ClNO3/c1-19-14(18)11-6-8-16(9-7-11)13(17)10-2-4-12(15)5-3-10/h2-5,11H,6-9H2,1H3

Composition: C (59.68%), H (5.72%), Cl (12.58%), N (4.97%), O (17.04%)

Molar Mass: 281.74

Atom Count: 35

Heavy Atom Count: 19

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 281.0818711
Formal Charge 0
FSP3 0.43
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey DFQSHQMQHOFSKC-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 72.89
Topological Polar Surface Area 46.61
Polarizability 28.01
Ring Count 2
Rotatable Bond Count 3

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C14H16ClNO3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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