Sodium Cyclamate - analytical standard , CAS No.139-05-9

CAS: 139-05-9 Cat. No.: S109885 Formula: C₆H₁₂NNaO₃S Peso molecolare: 201.22 Beilstein Registry Number: 4166868 Numero EC: 205-348-9 PubChem CID: 23665706

GRADE & PURITY Analytical standard

Synonyms

Assurgrin vollsuss | Cyclamate de sodium [INN-French] | Natriumzyklamate [German] | UDIPTWFVPPPURJ-UHFFFAOYSA-M | DB00485 | HY-W014839 | MLS004773942 | Cyclohexylsulfamate sodium | 1I6F42RME1 | C19378 | Ciclamato sodico | Sodium cyclohexyl amidosulphate |

Storage

Protected from light,Room temperature

Shipped In

Normal

Specifications

Sinonimi

Assurgrin vollsuss | Cyclamate de sodium [INN-French] | Natriumzyklamate [German] | UDIPTWFVPPPURJ-UHFFFAOYSA-M | DB00485 | HY-W014839 | MLS004773942 | Cyclohexylsulfamate sodium | 1I6F42RME1 | C19378 | Ciclamato sodico | Sodium cyclohexyl amidosulphate |

Specifiche e purezza

analytical standard

Meccanismi biochimici e fisiologici

人可察觉的苯氨基磺酸盐甜味剂。使用动物模型研究其潜在致癌作用的第一代甜味剂。

Condizioni di conservazione di stoccaggio

Protected from light,Room temperature

Spedito in

Normal

Grado

Standard analitico

Nomi e identificatori

Pubchem Sid

528773395

Sorrisi canonici

C1CCC(CC1)NS(=O)(=O)[O-].[Na+]

IUPAC Name

sodium;N-cyclohexylsulfamate

InChIKey

UDIPTWFVPPPURJ-UHFFFAOYSA-M

INCHI

1S/C6H13NO3S.Na/c8-11(9,10)7-6-4-2-1-3-5-6;/h6-7H,1-5H2,(H,8,9,10);/q;+1/p-1

Isomeri SMILES

C1CCC(CC1)NS(=O)(=O)[O-].[Na+]

WGK Germania

3

RTECS

GV7350000

PubChem CID

23665706

Peso molecolare

201.22

Beilstein

4166868

Reaxy-Rn

4166868

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Classe Sulfamic acid derivatives
      • Subclass Cyclamates

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Classe: Sulfamic acid derivatives
• Subclass: Cyclamates
• Intermediate Tree Nodes: Not available
• Direct Parent: Cyclamates
• Alternative Parents: Sulfuric acid monoamides Organopnictogen compounds Organonitrogen compounds Organic sodium salts Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Cyclamic_acid_derivative - Sulfuric acid monoamide - Organic sulfuric acid or derivatives - Organic alkali metal salt - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic sodium salt - Organic salt - Organonitrogen compound - Aliphatic homomonocyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as cyclamates. These are compounds containing a cyclohexylsulfamic acid moiety.
• External Descriptors: organic molecular entity

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

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CA2 Tclin Carbonic anhydrase II (17698 Activities)

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CA1 Tclin Carbonic anhydrase I (13240 Activities)

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CA14 Tclin Carbonic anhydrase XIV (1305 Activities)

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CA12 Tclin Carbonic anhydrase XII (6231 Activities)

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CA9 Tclin Carbonic anhydrase IX (8255 Activities)

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Homo sapiens (32628 Activities)

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TAS2R41 Tchem Taste receptor type 2 member 41 (57 Activities)

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Ca7 Carbonic anhydrase VII (3 Activities)

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Mus musculus (284745 Activities)

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Meccanismi d'azione

Proprietà chimiche e fisiche

• Sensibilità: Light sensitive.
• Punto di fusione (°C): >300°C
• Peso molecolare: 201.220 g/mol
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 201.044 Da
• Monoisotopic Mass: 201.044 Da
• Topological Polar Surface Area: 77.600 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 205.000
• 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: 2

XLogP3