CHES - ≥99%(T) , CAS No.103-47-9

CAS: 103-47-9 Cat. No.: C110898 Formula: C₈H₁₇NO₃S Peso molecolare: 207.29 Beilstein Registry Number: 2967601 Numero EC: 203-115-6

QUALITÀ & PUREZZA ≥99%(T)

Synonyms

CHES | 2-(Cyclohexylamino)ethanesulfonic acid pound CHES pound(c) | W-108849 | 2-(Cyclohexylamino)ethanesulfonic acid | CHES, Vetec(TM) reagent grade, 99% | DF6D31A1-88EA-4A0F-907D-9F40C66339BF | DB03309 | 2-(Cyclohexylamino)ethanesulphonic acid | HY-D08

Storage

Room temperature,Argon charged,Desiccated

Shipped In

Normal

Panoramica

CHES (2-(Cyclohexylamino)ethanesulfonic acid) is a zwitterionic N-substituted aminosulfonic acid. CHES is used as a buffer for studying pH-dependent processes in enzymology. The compound has been shown to have an unusually high affinity for the iodoacetate binding site of liver alcohol dehydrogenase. The compound, which has a has a pKa of 9.49 at 25°C, is useful for the pH 8.6-10.0 range.
A zwitterionic buffering agent.

Specifiche

Sinonimi

CHES | 2-(Cyclohexylamino)ethanesulfonic acid pound CHES pound(c) | W-108849 | 2-(Cyclohexylamino)ethanesulfonic acid | CHES, Vetec(TM) reagent grade, 99% | DF6D31A1-88EA-4A0F-907D-9F40C66339BF | DB03309 | 2-(Cyclohexylamino)ethanesulphonic acid | HY-D08

Specifiche e purezza

≥99%(T)

Condizioni di conservazione di stoccaggio

Room temperature,Argon charged,Desiccated

Spedito in

Normal

Purezza

≥99%(T)

Nomi e identificatori

Pubchem Sid

508808403

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/508808403

Sorrisi canonici

C1CCC(CC1)NCCS(=O)(=O)O

IUPAC Name

2-(cyclohexylamino)ethanesulfonic acid

InChIKey

MKWKNSIESPFAQN-UHFFFAOYSA-N

INCHI

1S/C8H17NO3S/c10-13(11,12)7-6-9-8-4-2-1-3-5-8/h8-9H,1-7H2,(H,10,11,12)

Isomeri SMILES

C1CCC(CC1)NCCS(=O)(=O)O

WGK Germania

3

Peso molecolare

207.29

Beilstein

2967601

Reaxy-Rn

2967601

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2967601&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Classe Organonitrogen compounds
      • Subclass Cyclohexylamines

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Classe: Organonitrogen compounds
• Subclass: Cyclohexylamines
• Intermediate Tree Nodes: Not available
• Direct Parent: Cyclohexylamines
• Alternative Parents: Sulfonyls Organosulfonic acids Alkanesulfonic acids Dialkylamines Organopnictogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Cyclohexylamine - Alkanesulfonic acid - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Secondary amine - Secondary aliphatic amine - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Amine - Aliphatic homomonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as cyclohexylamines. These are organic compounds containing a cyclohexylamine moiety, which consist of a cyclohexane ring attached to an amine group.
• External Descriptors: Not available

Data sources

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

Proprietà chimiche e fisiche

• Solubilità: Soluble in water (103.6 g/l) at 20 °C.
• Sensibilità: Hygroscopic
• Punto di fusione (°C): >300℃
• Peso molecolare: 207.290 g/mol
• XLogP3: -1.200
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 207.093 Da
• Monoisotopic Mass: 207.093 Da
• Topological Polar Surface Area: 74.800 Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 226.000
• 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