3-(2-N,N-Dimethylsulfamoylphenyl)-5-fluorobenzoic acid - 98%, high purity , CAS No.1261996-26-2

In stock

Item Number

N180931

Grouped product items
SKU	Size	Availability	Price	Qty
N180931-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,470.90

Basic Description

Synonyms	1261996-26-2 \| 2'-(N,N-Dimethylsulfamoyl)-5-fluoro-[1,1'-biphenyl]-3-carboxylic acid \| 3-(2-N,N-Dimethylsulfamoylphenyl)-5-fluorobenzoic acid \| 3-[2-(dimethylsulfamoyl)phenyl]-5-fluorobenzoic acid \| DTXSID70692274 \| MFCD18322934 \| 2'-(N,N-Dimethylsulfamoyl)-5-fluoro-
Specifications & Purity	≥98%
Storage Temp	Room temperature
Shipped In	Normal

Names and Identifiers

IUPAC Name	3-[2-(dimethylsulfamoyl)phenyl]-5-fluorobenzoic acid
INCHI	InChI=1S/C15H14FNO4S/c1-17(2)22(20,21)14-6-4-3-5-13(14)10-7-11(15(18)19)9-12(16)8-10/h3-9H,1-2H3,(H,18,19)
InChi Key	LWEJEDLHFHRGPV-UHFFFAOYSA-N
Canonical SMILES	CN(C)S(=O)(=O)C1=CC=CC=C1C2=CC(=CC(=C2)F)C(=O)O
Isomeric SMILES	CN(C)S(=O)(=O)C1=CC=CC=C1C2=CC(=CC(=C2)F)C(=O)O
PubChem CID	53228755
Molecular Weight	323.3

Chemical and Physical Properties

Molecular Weight	323.300 g/mol
XLogP3	2.300
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	4
Exact Mass	323.063 Da
Monoisotopic Mass	323.063 Da
Topological Polar Surface Area	83.100 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	502.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

Solution Calculators

Determine the necessary mass, volume, or concentration for preparing a solution.

Determine the dilution needed to prepare a stock solution.

Basic Description