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(1R,2R)-(+)-N,N′-Di-p-tosyl-1,2-cyclohexanediamine - 98%，98% e.e., high purity , CAS No.143585-47-1

COA

Cas Number: 143585-47-1
Molecular Weight: 422.6
MDL number: MFCD01321377
PubChem CID: 11146322
PubChem SID: 488197221

In stock

Item Number

R472254

Grouped product items
SKU	Size	Availability	Price
R472254-1g	1g	7	$15.90
R472254-5g	5g	6	$70.90
R472254-25g	25g	4	$315.90
R472254-100g	100g	2	$1,137.90

Basic Description

Synonyms	4-methyl-N-[(1R,2R)-2-[(4-methylphenyl)sulfonylamino]cyclohexyl]benzenesulfonamide \| D75432 \| AKOS027383596 \| N,N'-[(1R,2R)-Cyclohexane-1,2-diyl]bis(4-methylbenzene-1-sulfonamide) \| Benzenesulfonamide,N,N'-(1R,2R)-1,2-cyclohexanediylbis[4-methyl- \| N,N'-(
Specifications & Purity	≥98%,≥98%(ee)
Storage Temp	Store at 2-8°C,Argon charged
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Toluenes
      - Level5 Tosyl compounds
        Level6 P-toluenesulfonamides

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Toluenes
Intermediate Tree Nodes	Tosyl compounds
Direct Parent	P-toluenesulfonamides
Alternative Parents	Benzenesulfonamides Benzenesulfonyl compounds Organosulfonamides Aminosulfonyl compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	P-toluenesulfonamide - Benzenesulfonamide - Benzenesulfonyl group - Organosulfonic acid amide - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organonitrogen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as p-toluenesulfonamides. These are aromatic heterocyclic compounds containing a toluene that is p-substituted with a sulfonamide group.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

Pubchem Sid	488197221
IUPAC Name	4-methyl-N-[(1R,2R)-2-[(4-methylphenyl)sulfonylamino]cyclohexyl]benzenesulfonamide
INCHI	InChI=1S/C20H26N2O4S2/c1-15-7-11-17(12-8-15)27(23,24)21-19-5-3-4-6-20(19)22-28(25,26)18-13-9-16(2)10-14-18/h7-14,19-22H,3-6H2,1-2H3/t19-,20-/m1/s1
InChIKey	FIAAGQKYVFEMGC-WOJBJXKFSA-N
Smiles	CC1=CC=C(C=C1)S(=O)(=O)NC2CCCCC2NS(=O)(=O)C3=CC=C(C=C3)C
Isomeric SMILES	CC1=CC=C(C=C1)S(=O)(=O)N[C@@H]2CCCC[C@H]2NS(=O)(=O)C3=CC=C(C=C3)C
PubChem CID	11146322
Molecular Weight	422.6

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

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8 results found

Lot Number	Certificate Type	Date	Item
E23301079	Certificate of Analysis	May 08, 2023	R472254
E23301373	Certificate of Analysis	May 08, 2023	R472254
E23301081	Certificate of Analysis	May 08, 2023	R472254
E23301083	Certificate of Analysis	May 08, 2023	R472254
E23301080	Certificate of Analysis	May 08, 2023	R472254
E23301370	Certificate of Analysis	May 08, 2023	R472254
E23301085	Certificate of Analysis	May 08, 2023	R472254
E2330184	Certificate of Analysis	May 08, 2023	R472254

Chemical and Physical Properties

Specific Rotation[α]	[α]22/D −3°， c = 2.33 in pyridine
Melt Point(°C)	170-173°C
Molecular Weight	422.600 g/mol
XLogP3	3.600
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	6
Exact Mass	422.133 Da
Monoisotopic Mass	422.133 Da
Topological Polar Surface Area	109.000 Å²
Heavy Atom Count	28
Formal Charge	0
Complexity	633.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	2
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

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