Cyclohexanesulfonamide - ≥97% , CAS No.2438-38-2

CAS: 2438-38-2 Cat. No.: C192266 분자식: C₆H₁₃NO₂S 분자량: 163.24 EC 번호: 842-268-9

등급 & 순도 ≥97%

Synonyms

methyl 4-methyl-3-[(N-propylalanyl)amino]thiophene-2-carboxylate|Cyclohexanesulfonamide|Zyklohexansulfamid|6-Methoxynaphthalene-2-acetic acid|cyclohexanesulfonic acid amide|Phosphorothioic acid, O,O-diethyl O-(1-phenyl-1H-1,2,4-triazol-3-yl) ester|Cyclohexyl Sulfonamide|cyclohexylsulfonamide|Cyclohexanesulfonamide(7CI,8CI,9CI)|1-(Di-N-propoxyphosphinothioylthiomethylcarbonyl-2-methylpiperidine)

Storage

Store at -20°C,Desiccated

Shipped In

Ice chest + Ice pads

사양

동의어

methyl 4-methyl-3-[(N-propylalanyl)amino]thiophene-2-carboxylate | Cyclohexanesulfonamide | Zyklohexansulfamid | 6-Methoxynaphthalene-2-acetic acid | cyclohexanesulfonic acid amide | Phosphorothioic acid, O,O-diethyl O-(1-phenyl-1H-1,2,4-triazol-3-yl) ester | Cyclohexyl Sulfonamide | cyclohexylsulfonamide | Cyclohexanesulfonamide(7CI,8CI, Show more

사양 및 순도

≥97%

보관 조건

Store at -20°C,Desiccated

배송

Ice chest + Ice pads

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순수함

≥97%

Product Line

C192266-50mg

이름과 식별자

정식 스마일

C1CCC(CC1)S(=O)(=O)N

IUPAC Name

cyclohexanesulfonamide

InChIKey

AAYHAFZXFMIUSN-UHFFFAOYSA-N

INCHI

1S/C6H13NO2S/c7-10(8,9)6-4-2-1-3-5-6/h6H,1-5H2,(H2,7,8,9)

이성체 SMILES

C1CCC(CC1)S(=O)(=O)N

분자량

163.24

Reaxy-Rn

2716566

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2716566&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • 분류 Organic sulfonic acids and derivatives
      • Subclass Organosulfonic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• 분류: Organic sulfonic acids and derivatives
• Subclass: Organosulfonic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Organosulfonamides
• Alternative Parents: Organic sulfonamides Aminosulfonyl compounds Organic oxides Organic nitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Organosulfonic acid amide - Organic sulfonic acid amide - Aminosulfonyl compound - Sulfonyl - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Aliphatic homomonocyclic compound
• 설명: This compound belongs to the class of organic compounds known as organosulfonamides. These are compounds containing the sulfonamide functional group, an amide of sulfonic acid with the general structure R1S(=O)2N(R2)R3 (R1=alkyl, aryl; R2,R3=H, alkyl, aryl).
• 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

화학 및 물리적 특성

• 녹는점(°C): 94-95 °C
• 분자량: 163.240 g/mol
• XLogP3: 0.700
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 163.067 Da
• Monoisotopic Mass: 163.067 Da
• Topological Polar Surface Area: 68.500 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 186.000
• 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