N-(3-Nitro-thiobenzoyl)-piperidine structure

N-(3-Nitro-thiobenzoyl)-piperidine

(3-nitrophenyl)-piperidin-1-ylmethanethione

Also Known As: m-Nitrothiobenzopiperidide|N-(3-Nitro-thiobenzoyl)-piperidine|3-Nitro-thiobenzoesaeure-piperidid|1-(3-nitro-thiobenzoyl)-piperidine|1-(3-Nitrobenzothioyl)piperidine #|(3-nitrophenyl)-piperidin-1-ylmethanethione|3-Nitrophenyl 1-piperidinyl thioketone|(3-nitrophenyl)(piperidin-1-yl)methanethione|J1.019.541A|Piperidine, 1-[(3-nitrophenyl)thioxomethyl]-|1-(3-NITROBENZENECARBOTHIOYL)PIPERIDINE

CAS: 62764-89-0
Molecular Formula C12H14N2O2S
Molecular Weight 250.0776 g/mol
LogP 2.7
Topological Polar Surface Area 81.2 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 3
Rotatable Bonds 1
Exact Mass 250.0776
Monoisotopic Mass 250.0776
Heavy Atoms 17
Complexity 297.0

Chemical Identifiers

CAS Number 62764-89-0
SMILES C1CCN(CC1)C(=S)C2=CC(=CC=C2)[N+](=O)[O-]
InChIKey HJPBZJUHGLQOIN-UHFFFAOYSA-N

Product Overview

N-(3-Nitro-thiobenzoyl)-piperidine (CAS 62764-89-0), with molecular formula C12H14N2O2S and molecular weight 250.0776 g/mol. IUPAC: (3-nitrophenyl)-piperidin-1-ylmethanethione.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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