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3-bromo-6-methanesulfonylquinoline

3-bromo-6-methanesulfonylquinoline

CAS: 1860894-29-6

Formula: C10H8BrNO2S

SMILES: CS(=O)(=O)C1=CC=C2N=CC(Br)=CC2=C1

IUPAC: 3-bromo-6-methanesulfonylquinoline

InChI: InChI=1S/C10H8BrNO2S/c1-15(13,14)9-2-3-10-7(5-9)4-8(11)6-12-10/h2-6H,1H3

Composition: C (41.98%), H (2.82%), Br (27.92%), N (4.90%), O (11.18%), S (11.20%)

Molar Mass: 286.14

Atom Count: 23

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 284.945913
Formal Charge 0
FSP3 0.1
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey YLAFOXCQNDARIQ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 61.61
Topological Polar Surface Area 47.03
Polarizability 25.69
Ring Count 2
Rotatable Bond Count 1

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Purity LeadTime CAS PacketSize UnitPrice
95% <5 Days 1860894-29-6 $447.66-$877.66$447.66$877.66
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