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methyl 2-{N-[(3-chlorophenyl)methyl]methanesulfonamido}benzoate

methyl 2-{N-[(3-chlorophenyl)methyl]methanesulfonamido}benzoate

Formula: C16H16ClNO4S

SMILES: COC(=O)C1=CC=CC=C1N(CC1=CC=CC(Cl)=C1)S(C)(=O)=O

IUPAC: methyl 2-{N-[(3-chlorophenyl)methyl]methanesulfonamido}benzoate

InChI: InChI=1S/C16H16ClNO4S/c1-22-16(19)14-8-3-4-9-15(14)18(23(2,20)21)11-12-6-5-7-13(17)10-12/h3-10H,11H2,1-2H3

Composition: C (54.32%), H (4.56%), Cl (10.02%), N (3.96%), O (18.09%), S (9.06%)

Molar Mass: 353.82

Atom Count: 39

Heavy Atom Count: 23

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 353.0488569
Formal Charge 0
FSP3 0.19
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey RXDWVZYAMKSFRJ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 89.08
Topological Polar Surface Area 63.68
Polarizability 35.24
Ring Count 2
Rotatable Bond Count 5

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C16H16ClNO4S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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