Skip to the beginning of the images gallery

4-Methyl-1-piperazinesulfonyl Chloride - ≥95%, high purity , CAS No.1688-95-5

COA

Grade & Purity:

≥95%

Cas Number: 1688-95-5
Molecular Weight: 198.67
MDL number: MFCD09731871
PubChem CID: 11171617
PubChem SID: 504766115

In stock

Item Number

D305141

Grouped product items
SKU	Size	Availability	Price
D305141-250mg	250mg	3	$33.90
D305141-1g	1g	2	$91.90
D305141-5g	5g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$315.90

Basic Description

Synonyms	4-methylpiperazine-1-sulfonyl Chloride \| 1688-95-5 \| 4-Methyl-1-piperazinesulfonyl Chloride \| 1-Piperazinesulfonyl chloride, 4-methyl- \| MFCD09731871 \| 4-methyl-piperazin-1-ylsulphonyl chloride \| 4-Methyl-1-piperazinesulfonylChloride \| SCHEMBL1606347 \| DTXSID40457579 \| GDY
Specifications & Purity	≥95%
Storage Temp	Room temperature,Argon charged,Desiccated
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Diazinanes
    - Subclass Piperazines
      - Level5 N-alkylpiperazines
        Level6 N-methylpiperazines

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Diazinanes
Subclass	Piperazines
Intermediate Tree Nodes	N-alkylpiperazines
Direct Parent	N-methylpiperazines
Alternative Parents	Trialkylamines Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aliphatic heteromonocyclic compounds
Substituents	N-methylpiperazine - Tertiary aliphatic amine - Tertiary amine - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Amine - Aliphatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as n-methylpiperazines. These are organic compounds containing a piperazine ring where the nitrogen ring atom carries a methyl 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	504766115
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504766115
IUPAC Name	4-methylpiperazine-1-sulfonyl chloride
INCHI	InChI=1S/C5H11ClN2O2S/c1-7-2-4-8(5-3-7)11(6,9)10/h2-5H2,1H3
InChIKey	GDYYZWFHNRVHCC-UHFFFAOYSA-N
Smiles	CN1CCN(CC1)S(=O)(=O)Cl
Isomeric SMILES	CN1CCN(CC1)S(=O)(=O)Cl
Molecular Weight	198.67
Reaxy-Rn	608912
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=608912&ln=

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

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

6 results found

Lot Number	Certificate Type	Date	Item
J2331197	Certificate of Analysis	Aug 26, 2023	D305141
J2331247	Certificate of Analysis	Aug 26, 2023	D305141
J2331248	Certificate of Analysis	Aug 26, 2023	D305141
J2331198	Certificate of Analysis	Aug 26, 2023	D305141
J2331195	Certificate of Analysis	Aug 26, 2023	D305141
J2331196	Certificate of Analysis	Aug 26, 2023	D305141

Chemical and Physical Properties

Flash Point(°C)	124.4±24.3 ºC
Boil Point(°C)	282.1±29.0 ºC
Molecular Weight	198.670 g/mol
XLogP3	0.100
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Exact Mass	198.023 Da
Monoisotopic Mass	198.023 Da
Topological Polar Surface Area	49.000 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	215.000
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

Molarity Calculator

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

Mass

Concentration

Volume

M. Wt*

g/mol

*When preparing stock solutions, always use the batch-specific molecular weight of the product found on the vial label and the Certificate of Analysis (available online).

Dilution Calculator

Determine the dilution needed to prepare a stock solution.

Concentration 1 (C1)

Volume 1 (V1)

Concentration 2 (C2)

Volume 2 (V2)

Reconstitution Calculator

The reconstitution calculator enables you to quickly determine the volume of a reagent needed to reconstitute your vial. Just enter the mass of the reagent and the target concentration, and the calculator will do the rest.

Volume (to add to vial)

Mass (in vial)

Desired Reconstitution Concentration