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3-chloro-2'-(dimethylsulfamoyl)-[1,1'-biphenyl]-4-carboxylic acid

3-chloro-2'-(dimethylsulfamoyl)-[1,1'-biphenyl]-4-carboxylic acid

CAS: 1261939-26-7

Formula: C15H14ClNO4S

SMILES: CN(C)S(=O)(=O)C1=CC=CC=C1C1=CC=C(C(O)=O)C(Cl)=C1

IUPAC: 3-chloro-2'-(dimethylsulfamoyl)-[1,1'-biphenyl]-4-carboxylic acid

InChI: InChI=1S/C15H14ClNO4S/c1-17(2)22(20,21)14-6-4-3-5-11(14)10-7-8-12(15(18)19)13(16)9-10/h3-9H,1-2H3,(H,18,19)

Composition: C (53.02%), H (4.15%), Cl (10.43%), N (4.12%), O (18.83%), S (9.44%)

Molar Mass: 339.79

Atom Count: 36

Heavy Atom Count: 22

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 339.0332068
Formal Charge 0
FSP3 0.13
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey CUJDYYKXRFEKKF-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 85.21
Topological Polar Surface Area 74.68
Polarizability 34.46
Ring Count 2
Rotatable Bond Count 3

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Purity LeadTime CAS PacketSize UnitPrice
96% <6 Days 1261939-26-7 $409.40-$1,061.45$409.40$1,061.45
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