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2-chloro-3-methanesulfonyl-4-methyl-6-phenylpyridine

2-chloro-3-methanesulfonyl-4-methyl-6-phenylpyridine

CAS: 343372-81-6

Formula: C13H12ClNO2S

SMILES: CC1=C(C(Cl)=NC(=C1)C1=CC=CC=C1)S(C)(=O)=O

IUPAC: 2-chloro-3-methanesulfonyl-4-methyl-6-phenylpyridine

InChI: InChI=1S/C13H12ClNO2S/c1-9-8-11(10-6-4-3-5-7-10)15-13(14)12(9)18(2,16)17/h3-8H,1-2H3

Composition: C (55.42%), H (4.29%), Cl (12.58%), N (4.97%), O (11.36%), S (11.38%)

Molar Mass: 281.75

Atom Count: 30

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 281.0277275
Formal Charge 0
FSP3 0.15
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey SIXMINCSXACYOV-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 73.58
Topological Polar Surface Area 47.03
Polarizability 30.08
Ring Count 2
Rotatable Bond Count 2

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Purity LeadTime CAS PacketSize UnitPrice
90% <2 Days 343372-81-6 $51.35-$86.31$51.35$63.37$86.31
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