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4-[2-(phenylsulfanyl)ethyl]pyridine hydrochloride

4-[2-(phenylsulfanyl)ethyl]pyridine hydrochloride

Formula: C13H14ClNS

SMILES: Cl.C(CC1=CC=NC=C1)SC1=CC=CC=C1

IUPAC: 4-[2-(phenylsulfanyl)ethyl]pyridine hydrochloride

InChI: InChI=1S/C13H13NS.ClH/c1-2-4-13(5-3-1)15-11-8-12-6-9-14-10-7-12;/h1-7,9-10H,8,11H2;1H

Composition: C (62.02%), H (5.61%), Cl (14.08%), N (5.56%), S (12.73%)

Molar Mass: 251.77

Atom Count: 30

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 251.0535483
Formal Charge 0
FSP3 0.15
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 0
InChIKey WKFNXURMDAVCKV-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 66.08
Topological Polar Surface Area 12.89
Polarizability 25.72
Ring Count 2
Rotatable Bond Count 4

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C13H14ClNS $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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