Cystamine Sulfate - ≥98%(T) , CAS No.16214-16-7

CAS: 16214-16-7 Cat. No.: C135558 分子式: C₄H₁₂N₂S₂·H₂SO₄ 分子量: 250.35 EC番号: 240-340-9

GRADE & PURITY ≥98%(T)

Synonyms

D97659 | 2-(2-aminoethyldisulfanyl)ethanamine;sulfuric acid | 2-[(2-aminoethyl)disulfanyl]ethan-1-amine; sulfuric acid | AS-64968 | J-019513 | 2,2'-Disulfanediyldiethanamine sulfate | Sulfuric acid--2,2'-disulfanediyldi(ethan-1-amine) (1/1) | 2,2'-Diamino

Storage

Room temperature

Shipped In

Normal

Specifications

同義語

D97659 | 2-(2-aminoethyldisulfanyl)ethanamine;sulfuric acid | 2-[(2-aminoethyl)disulfanyl]ethan-1-amine; sulfuric acid | AS-64968 | J-019513 | 2,2'-Disulfanediyldiethanamine sulfate | Sulfuric acid--2,2'-disulfanediyldi(ethan-1-amine) (1/1) | 2,2'-Diamino

仕様と純度

≥98%(T)

保管条件

Room temperature

入荷

Normal

純度

≥98%(T)

名前と識別子

• カノニカル・スマイル: C(CSSCCN)N.OS(=O)(=O)O
• IUPAC Name: 2-(2-aminoethyldisulfanyl)ethanamine;sulfuric acid
• InChIKey: XVCYODCCYCPADG-UHFFFAOYSA-N
• INCHI: 1S/C4H12N2S2.H2O4S/c5-1-3-7-8-4-2-6;1-5(2,3)4/h1-6H2;(H2,1,2,3,4)
• 異性体SMILES: C(CSSCCN)N.OS(=O)(=O)O
• 代替CAS番号: 342385-53-9；51-85-4；56-17-7
• 分子量: 250.35
• Reaxy-Rn: 28505383
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=28505383&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • 分類 Organic sulfuric acids and derivatives
      • Subclass Organic sulfuric acids

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• 分類: Organic sulfuric acids and derivatives
• Subclass: Organic sulfuric acids
• Intermediate Tree Nodes: Not available
• Direct Parent: Organic sulfuric acids
• Alternative Parents: Dialkyldisulfides Sulfenyl compounds Organic oxides Monoalkylamines Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Sulfuric acid - Dialkyldisulfide - Organic disulfide - Sulfenyl compound - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Primary amine - Organosulfur compound - Organonitrogen compound - Primary aliphatic amine - Amine - Aliphatic acyclic compound
• 説明: This compound belongs to the class of organic compounds known as organic sulfuric acids. These are organic compounds containing the sulfuric acid functional group, with the generic structure HOS(=O)(=O)OH.
• 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

化学的性質と物理的性質

• 分子量: 250.400 g/mol
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 5
• Exact Mass: 250.012 Da
• Monoisotopic Mass: 250.012 Da
• Topological Polar Surface Area: 186.000 Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 118.000
• 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